Product Name

  • Name

    (+)-(3R,4R)-3,4-DIMETHYL-4-(3-HYDROXYPHENYL)PIPERIDINE

  • EINECS 1592732-453-0
  • CAS No. 119193-19-0
  • Article Data7
  • CAS DataBase
  • Density 1.009 g/cm3
  • Solubility
  • Melting Point 174-175 °C
  • Formula C13H19NO
  • Boiling Point 335.464 °C at 760 mmHg
  • Molecular Weight 205.3
  • Flash Point 115.716 °C
  • Transport Information
  • Appearance white like or light brown crystalline powder
  • Safety
  • Risk Codes  Xi:Irritant;
  • Molecular Structure Molecular Structure of 119193-19-0 ((+)-(3R,4R)-3,4-DIMETHYL-4-(3-HYDROXYPHENYL)PIPERIDINE)
  • Hazard Symbols IrritantXi
  • Synonyms Phenol,3-(3,4-dimethyl-4-piperidinyl)-, (3R-cis)-;(+)-(3R,4R)-3,4-Dimethyl-4-(3-hydroxyphenyl)piperidine;(+)-(3R,4R)-Dimethyl-4-(3-hydroxyphenyl)piperidine;3-[(3R,4R)-3,4-Dimethyl-4-piperidinyl]phenol;
  • PSA 32.26000
  • LogP 2.60810

Synthetic route

(3R,4R)-3,4-dimethyl-4-<3-(1-methylethoxy)phenyl>piperidinecarboxylic acid phenyl ester
145678-86-0

(3R,4R)-3,4-dimethyl-4-<3-(1-methylethoxy)phenyl>piperidinecarboxylic acid phenyl ester

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
With hydrogen bromide In acetic acid Reflux;88%
With sodium hydroxide; hydrogen bromide; acetic acid 1.) reflux, 19 h, 2.) MeOH, pH 10.3-10.5, 25 deg C, 1.5 h; Yield given. Multistep reaction;
(3R,4R)-4-(3-methoxyphenyl)-3,4-dimethylpiperidine
149655-33-4

(3R,4R)-4-(3-methoxyphenyl)-3,4-dimethylpiperidine

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
With hydrogen bromide In acetic acid for 18h; Heating; Yield given;
With hydrogen bromide; acetic acid Heating;
C9H16NO3SBr
951240-63-4

C9H16NO3SBr

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 9 steps
1.1: triethylamine; 4-(dimethylamino)pyridine / CH2Cl2 / 2.5 h / 0 - 20 °C
2.1: CuBr*SMe2 / tetrahydrofuran; diethyl ether / -40 - -35 °C
3.1: sodium carbonate / Pd(Ph3P)4 / ethanol; toluene; H2O / 0.75 h / 80 °C
4.1: anisole; triflic acid / CH2Cl2 / 0.5 h / 0 °C
5.1: sodium cyanoborohydride / acetonitrile; H2O / 0.5 h
6.1: n-butyllithium / tetrahydrofuran / -15 °C
6.2: tetrahydrofuran / -50 °C
7.1: sodium borohydride / methanol
8.1: phenyl chloroformate / toluene
9.1: hydrogen bromide; acetic acid / Heating
View Scheme
C13H25NO6SBrP
951240-64-5

C13H25NO6SBrP

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 8 steps
1.1: CuBr*SMe2 / tetrahydrofuran; diethyl ether / -40 - -35 °C
2.1: sodium carbonate / Pd(Ph3P)4 / ethanol; toluene; H2O / 0.75 h / 80 °C
3.1: anisole; triflic acid / CH2Cl2 / 0.5 h / 0 °C
4.1: sodium cyanoborohydride / acetonitrile; H2O / 0.5 h
5.1: n-butyllithium / tetrahydrofuran / -15 °C
5.2: tetrahydrofuran / -50 °C
6.1: sodium borohydride / methanol
7.1: phenyl chloroformate / toluene
8.1: hydrogen bromide; acetic acid / Heating
View Scheme
C10H18NO2SBr
951240-65-6

C10H18NO2SBr

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 7 steps
1.1: sodium carbonate / Pd(Ph3P)4 / ethanol; toluene; H2O / 0.75 h / 80 °C
2.1: anisole; triflic acid / CH2Cl2 / 0.5 h / 0 °C
3.1: sodium cyanoborohydride / acetonitrile; H2O / 0.5 h
4.1: n-butyllithium / tetrahydrofuran / -15 °C
4.2: tetrahydrofuran / -50 °C
5.1: sodium borohydride / methanol
6.1: phenyl chloroformate / toluene
7.1: hydrogen bromide; acetic acid / Heating
View Scheme
C17H25O3SN
951240-66-7

C17H25O3SN

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 6 steps
1.1: anisole; triflic acid / CH2Cl2 / 0.5 h / 0 °C
2.1: sodium cyanoborohydride / acetonitrile; H2O / 0.5 h
3.1: n-butyllithium / tetrahydrofuran / -15 °C
3.2: tetrahydrofuran / -50 °C
4.1: sodium borohydride / methanol
5.1: phenyl chloroformate / toluene
6.1: hydrogen bromide; acetic acid / Heating
View Scheme
C13H17ON
951240-71-4

C13H17ON

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 5 steps
1.1: sodium cyanoborohydride / acetonitrile; H2O / 0.5 h
2.1: n-butyllithium / tetrahydrofuran / -15 °C
2.2: tetrahydrofuran / -50 °C
3.1: sodium borohydride / methanol
4.1: phenyl chloroformate / toluene
5.1: hydrogen bromide; acetic acid / Heating
View Scheme
C14H19ON
220503-22-0

C14H19ON

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 4 steps
1.1: n-butyllithium / tetrahydrofuran / -15 °C
1.2: tetrahydrofuran / -50 °C
2.1: sodium borohydride / methanol
3.1: phenyl chloroformate / toluene
4.1: hydrogen bromide; acetic acid / Heating
View Scheme
C15H21ON

C15H21ON

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: sodium borohydride / methanol
2: phenyl chloroformate / toluene
3: hydrogen bromide; acetic acid / Heating
View Scheme
C9H15NO4S

C9H15NO4S

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 13 steps
1.1: 1.68 g / triethylsilane; BF3*OEt2 / CH2Cl2 / 3 h / 0 °C
2.1: bromine / CH2Cl2 / 0.5 h / 0 °C
3.1: 0.73 g / triethylamine / CH2Cl2 / 0.5 h / 0 °C
4.1: (R)-1-Me-3,3-Ph-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole; borane-N,N-diethylaniline complex / tetrahydrofuran / 16 h / 0 - 20 °C
5.1: triethylamine; 4-(dimethylamino)pyridine / CH2Cl2 / 2.5 h / 0 - 20 °C
6.1: CuBr*SMe2 / tetrahydrofuran; diethyl ether / -40 - -35 °C
7.1: sodium carbonate / Pd(Ph3P)4 / ethanol; toluene; H2O / 0.75 h / 80 °C
8.1: anisole; triflic acid / CH2Cl2 / 0.5 h / 0 °C
9.1: sodium cyanoborohydride / acetonitrile; H2O / 0.5 h
10.1: n-butyllithium / tetrahydrofuran / -15 °C
10.2: tetrahydrofuran / -50 °C
11.1: sodium borohydride / methanol
12.1: phenyl chloroformate / toluene
13.1: hydrogen bromide; acetic acid / Heating
View Scheme
C9H15NO3S
951240-61-2

C9H15NO3S

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 12 steps
1.1: bromine / CH2Cl2 / 0.5 h / 0 °C
2.1: 0.73 g / triethylamine / CH2Cl2 / 0.5 h / 0 °C
3.1: (R)-1-Me-3,3-Ph-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole; borane-N,N-diethylaniline complex / tetrahydrofuran / 16 h / 0 - 20 °C
4.1: triethylamine; 4-(dimethylamino)pyridine / CH2Cl2 / 2.5 h / 0 - 20 °C
5.1: CuBr*SMe2 / tetrahydrofuran; diethyl ether / -40 - -35 °C
6.1: sodium carbonate / Pd(Ph3P)4 / ethanol; toluene; H2O / 0.75 h / 80 °C
7.1: anisole; triflic acid / CH2Cl2 / 0.5 h / 0 °C
8.1: sodium cyanoborohydride / acetonitrile; H2O / 0.5 h
9.1: n-butyllithium / tetrahydrofuran / -15 °C
9.2: tetrahydrofuran / -50 °C
10.1: sodium borohydride / methanol
11.1: phenyl chloroformate / toluene
12.1: hydrogen bromide; acetic acid / Heating
View Scheme
C9H15NO3SBr2

C9H15NO3SBr2

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 11 steps
1.1: 0.73 g / triethylamine / CH2Cl2 / 0.5 h / 0 °C
2.1: (R)-1-Me-3,3-Ph-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole; borane-N,N-diethylaniline complex / tetrahydrofuran / 16 h / 0 - 20 °C
3.1: triethylamine; 4-(dimethylamino)pyridine / CH2Cl2 / 2.5 h / 0 - 20 °C
4.1: CuBr*SMe2 / tetrahydrofuran; diethyl ether / -40 - -35 °C
5.1: sodium carbonate / Pd(Ph3P)4 / ethanol; toluene; H2O / 0.75 h / 80 °C
6.1: anisole; triflic acid / CH2Cl2 / 0.5 h / 0 °C
7.1: sodium cyanoborohydride / acetonitrile; H2O / 0.5 h
8.1: n-butyllithium / tetrahydrofuran / -15 °C
8.2: tetrahydrofuran / -50 °C
9.1: sodium borohydride / methanol
10.1: phenyl chloroformate / toluene
11.1: hydrogen bromide; acetic acid / Heating
View Scheme
C9H14NO3SBr
951240-62-3

C9H14NO3SBr

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 10 steps
1.1: (R)-1-Me-3,3-Ph-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole; borane-N,N-diethylaniline complex / tetrahydrofuran / 16 h / 0 - 20 °C
2.1: triethylamine; 4-(dimethylamino)pyridine / CH2Cl2 / 2.5 h / 0 - 20 °C
3.1: CuBr*SMe2 / tetrahydrofuran; diethyl ether / -40 - -35 °C
4.1: sodium carbonate / Pd(Ph3P)4 / ethanol; toluene; H2O / 0.75 h / 80 °C
5.1: anisole; triflic acid / CH2Cl2 / 0.5 h / 0 °C
6.1: sodium cyanoborohydride / acetonitrile; H2O / 0.5 h
7.1: n-butyllithium / tetrahydrofuran / -15 °C
7.2: tetrahydrofuran / -50 °C
8.1: sodium borohydride / methanol
9.1: phenyl chloroformate / toluene
10.1: hydrogen bromide; acetic acid / Heating
View Scheme
3-methoxyphenylboronic acid
10365-98-7

3-methoxyphenylboronic acid

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 7 steps
1.1: sodium carbonate / Pd(Ph3P)4 / ethanol; toluene; H2O / 0.75 h / 80 °C
2.1: anisole; triflic acid / CH2Cl2 / 0.5 h / 0 °C
3.1: sodium cyanoborohydride / acetonitrile; H2O / 0.5 h
4.1: n-butyllithium / tetrahydrofuran / -15 °C
4.2: tetrahydrofuran / -50 °C
5.1: sodium borohydride / methanol
6.1: phenyl chloroformate / toluene
7.1: hydrogen bromide; acetic acid / Heating
View Scheme
(+)-1,3(R),4(R)-Trimethyl-4-(3-methoxyphenyl)piperidine
132697-07-5

(+)-1,3(R),4(R)-Trimethyl-4-(3-methoxyphenyl)piperidine

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: phenyl chloroformate / toluene
2: hydrogen bromide; acetic acid / Heating
View Scheme
Multi-step reaction with 2 steps
1: 1) Proton sponge, vinyl chloroformate, 2) HCl gas / 1) 1,2-dichloroethane, reflux, 5 h, 2) EtOH, reflux, 3 h
2: aq. HBr / acetic acid / 18 h / Heating
View Scheme
(3R,5R)-1,3,4-trimethyl-4-<3-(1-methylethoxy)phenyl>piperidine
143919-34-0

(3R,5R)-1,3,4-trimethyl-4-<3-(1-methylethoxy)phenyl>piperidine

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 97 percent / toluene / 2 h / Heating
2: 1.) 48percent HBr, glacial AcOH, 2.) aq. NaOH / 1.) reflux, 19 h, 2.) MeOH, pH 10.3-10.5, 25 deg C, 1.5 h
View Scheme
Multi-step reaction with 3 steps
1.1: ethanol / 25 - 35 °C
2.1: HO-
2.2: 2 h / Reflux
3.1: hydrogen bromide / acetic acid / Reflux
View Scheme
(3RS,4SR)-1,2,3,4-tetrahydro-1,3,4-trimethyl-4-<3-(1-methylethoxy)phenyl>pyridine

(3RS,4SR)-1,2,3,4-tetrahydro-1,3,4-trimethyl-4-<3-(1-methylethoxy)phenyl>pyridine

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: NaBH4 / methanol / 3 h / 25 °C
2: 97 percent / toluene / 2 h / Heating
3: 1.) 48percent HBr, glacial AcOH, 2.) aq. NaOH / 1.) reflux, 19 h, 2.) MeOH, pH 10.3-10.5, 25 deg C, 1.5 h
View Scheme
C20H23NO3

C20H23NO3

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Stage #1: C20H23NO3 With hydrogen bromide; acetic acid for 18h; Heating / reflux;
Stage #2: With sodium hydroxide; water at 10 - 30℃; for 1h; pH=1.7;		n/a
Stage #1: C20H23NO3 With hydrogen bromide; acetic acid In water at 10 - 60℃; for 18h; Heating / reflux;
Stage #2: With sodium hydroxide In water at 10 - 30℃; for 1h; pH=< 1.7;
Stage #1: C20H23NO3 With hydrogen bromide; acetic acid In water at 50 - 60℃; for 18h; Heating / reflux;
Stage #2: With sodium hydroxide In water at 10 - 60℃; for 1h; pH=< 1.7;
(R)-1,2,3,4-tetrahydro-1,3-dimethyl-4-<3-(1-methylethoxy)phenyl>pyridine
143919-32-8

(R)-1,2,3,4-tetrahydro-1,3-dimethyl-4-<3-(1-methylethoxy)phenyl>pyridine

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 5 steps
1.1: n-butyllithium / tetrahydrofuran / 3 h / -60 - -55 °C
2.1: sodium tetrahydroborate / methanol / 25 - 35 °C
3.1: ethanol / 25 - 35 °C
4.1: HO-
4.2: 2 h / Reflux
5.1: hydrogen bromide / acetic acid / Reflux
View Scheme
(3R,4S)-1,2,3,4-tetrahydro-1,3,4-trimethyl-4-<3-(1-methylethoxy)phenyl>pyridine

(3R,4S)-1,2,3,4-tetrahydro-1,3,4-trimethyl-4-<3-(1-methylethoxy)phenyl>pyridine

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 4 steps
1.1: sodium tetrahydroborate / methanol / 25 - 35 °C
2.1: ethanol / 25 - 35 °C
3.1: HO-
3.2: 2 h / Reflux
4.1: hydrogen bromide / acetic acid / Reflux
View Scheme
C17H27NO*C20H18O8
1184775-81-2, 145415-19-6

C17H27NO*C20H18O8

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1.1: HO-
1.2: 2 h / Reflux
2.1: hydrogen bromide / acetic acid / Reflux
View Scheme
3-(isopropyloxy)phenylbromide
131738-73-3

3-(isopropyloxy)phenylbromide

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 9 steps
1.1: n-butyllithium / tetrahydrofuran / -65 °C
2.1: ethyl acetate / 25 - 35 °C
3.1: (2S,3S)-di-4-toluoyltartaric acid / ethanol / 20 h / 25 - 35 °C / Resolution of racemate
4.1: decalin / 190 - 195 °C
5.1: n-butyllithium / tetrahydrofuran / 3 h / -60 - -55 °C
6.1: sodium tetrahydroborate / methanol / 25 - 35 °C
7.1: ethanol / 25 - 35 °C
8.1: HO-
8.2: 2 h / Reflux
9.1: hydrogen bromide / acetic acid / Reflux
View Scheme
1,3-dimethyl-4-piperidinone
4629-80-5

1,3-dimethyl-4-piperidinone

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 9 steps
1.1: n-butyllithium / tetrahydrofuran / -65 °C
2.1: ethyl acetate / 25 - 35 °C
3.1: (2S,3S)-di-4-toluoyltartaric acid / ethanol / 20 h / 25 - 35 °C / Resolution of racemate
4.1: decalin / 190 - 195 °C
5.1: n-butyllithium / tetrahydrofuran / 3 h / -60 - -55 °C
6.1: sodium tetrahydroborate / methanol / 25 - 35 °C
7.1: ethanol / 25 - 35 °C
8.1: HO-
8.2: 2 h / Reflux
9.1: hydrogen bromide / acetic acid / Reflux
View Scheme
1,3-dimethyl-4-[3-(propan-2-yloxy)phenyl]-4-piperidinol
145340-44-9

1,3-dimethyl-4-[3-(propan-2-yloxy)phenyl]-4-piperidinol

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 8 steps
1.1: ethyl acetate / 25 - 35 °C
2.1: (2S,3S)-di-4-toluoyltartaric acid / ethanol / 20 h / 25 - 35 °C / Resolution of racemate
3.1: decalin / 190 - 195 °C
4.1: n-butyllithium / tetrahydrofuran / 3 h / -60 - -55 °C
5.1: sodium tetrahydroborate / methanol / 25 - 35 °C
6.1: ethanol / 25 - 35 °C
7.1: HO-
7.2: 2 h / Reflux
8.1: hydrogen bromide / acetic acid / Reflux
View Scheme
cis-(-)-carbonic acid ethyl 1,3-dimethyl-4-[3-(l-methylethoxy)phenyl]-4-piperidinyl ester

cis-(-)-carbonic acid ethyl 1,3-dimethyl-4-[3-(l-methylethoxy)phenyl]-4-piperidinyl ester

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 7 steps
1.1: (2S,3S)-di-4-toluoyltartaric acid / ethanol / 20 h / 25 - 35 °C / Resolution of racemate
2.1: decalin / 190 - 195 °C
3.1: n-butyllithium / tetrahydrofuran / 3 h / -60 - -55 °C
4.1: sodium tetrahydroborate / methanol / 25 - 35 °C
5.1: ethanol / 25 - 35 °C
6.1: HO-
6.2: 2 h / Reflux
7.1: hydrogen bromide / acetic acid / Reflux
View Scheme
C19H29NO4

C19H29NO4

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Conditions
ConditionsYield
Multi-step reaction with 6 steps
1.1: decalin / 190 - 195 °C
2.1: n-butyllithium / tetrahydrofuran / 3 h / -60 - -55 °C
3.1: sodium tetrahydroborate / methanol / 25 - 35 °C
4.1: ethanol / 25 - 35 °C
5.1: HO-
5.2: 2 h / Reflux
6.1: hydrogen bromide / acetic acid / Reflux
View Scheme
di-tert-butyl dicarbonate
24424-99-5

di-tert-butyl dicarbonate

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

4(R)-(3-hydroxyphenyl)-3(R),4-dimethyl-1-tert-butyloxycarbonylpiperidine
205999-74-2

4(R)-(3-hydroxyphenyl)-3(R),4-dimethyl-1-tert-butyloxycarbonylpiperidine

Conditions
ConditionsYield
With triethylamine In tetrahydrofuran at 25℃;100%
With triethylamine In tetrahydrofuran at 20℃; for 2h;100%
With triethylamine In tetrahydrofuran at 0 - 20℃; for 19h;100%
With triethylamine In tetrahydrofuran for 2h;
trifluoromethylsulfonic anhydride
358-23-6

trifluoromethylsulfonic anhydride

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

3-[(3R,4R)-3,4-dimethyl-1-(trifluoromethane)sulfonylpiperidin-4-yl]phenyl trifluoromethanesulfonate

3-[(3R,4R)-3,4-dimethyl-1-(trifluoromethane)sulfonylpiperidin-4-yl]phenyl trifluoromethanesulfonate

Conditions
ConditionsYield
With N-ethyl-N,N-diisopropylamine In dichloromethane at -78 - 20℃;100%
With N-ethyl-N,N-diisopropylamine In dichloromethane at -78 - 20℃;100%
3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

acrylic acid methyl ester
292638-85-8

acrylic acid methyl ester

methyl (3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinepropanoate
170098-39-2

methyl (3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinepropanoate

Conditions
ConditionsYield
In tetrahydrofuran at 40 - 45℃; for 4h;98%
In tetrahydrofuran at 45℃; for 4h;96%
In tetrahydrofuran at 40 - 45℃; for 18.5 - 19.5h;
Stage #1: 3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol; acrylic acid methyl ester In tetrahydrofuran at 40 - 45℃; for 18.5 - 19.5h;
Stage #2: With hyflo supercel
3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

3-oxocyclohex-1-en-1-yl 4-methylbenzenesulfonate
77708-66-8

3-oxocyclohex-1-en-1-yl 4-methylbenzenesulfonate

1-(3'-oxo-1'-cyclohexenyl)-(3R,4R)-dimethyl-(3-hydroxyphenyl)piperidine
205999-78-6

1-(3'-oxo-1'-cyclohexenyl)-(3R,4R)-dimethyl-(3-hydroxyphenyl)piperidine

Conditions
ConditionsYield
With triethylamine In tetrahydrofuran for 8h; Heating;90%
3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

3-oxocyclopent-1-en-1-yl 4-methylbenzenesulfonate
205999-79-7

3-oxocyclopent-1-en-1-yl 4-methylbenzenesulfonate

1-(3'-oxo-1'-cyclopentenyl)-(3R,4R)-dimethyl-(3-hydroxyphenyl)piperidine
205999-80-0

1-(3'-oxo-1'-cyclopentenyl)-(3R,4R)-dimethyl-(3-hydroxyphenyl)piperidine

Conditions
ConditionsYield
With triethylamine In tetrahydrofuran for 8h; Heating;90%
3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

3-cyclohexyl-3-hydroxypropyl (4-bromobenzene)sulfonate

3-cyclohexyl-3-hydroxypropyl (4-bromobenzene)sulfonate

(+)-1-(3(S)-3-hydroxy-3-cyclohexylpropyl)-3(R),4(R)-dimethyl-4-(3-hydroxyphenyl)piperidine
119193-09-8

(+)-1-(3(S)-3-hydroxy-3-cyclohexylpropyl)-3(R),4(R)-dimethyl-4-(3-hydroxyphenyl)piperidine

Conditions
ConditionsYield
With sodium hydrogencarbonate In 1,2-dimethoxyethane for 8h; Heating;82%
ethyl N-[(2S)-2-benzyl-3-{[(4-bromophenyl)sulfonyl]oxy}propanoyl]glycinate
1352995-69-7

ethyl N-[(2S)-2-benzyl-3-{[(4-bromophenyl)sulfonyl]oxy}propanoyl]glycinate

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

ethyl N-{(2S)-2-benzyl-3-[(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl]propanoyl}glycinate

ethyl N-{(2S)-2-benzyl-3-[(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl]propanoyl}glycinate

Conditions
ConditionsYield
With sodium hydrogencarbonate In 1,2-dimethoxyethane at 25 - 85℃; Reflux;80%
phenylacetaldehyde
122-78-1

phenylacetaldehyde

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

3-((3R,4R)-3,4-Dimethyl-1-phenethyl-piperidin-4-yl)-phenol
654647-95-7

3-((3R,4R)-3,4-Dimethyl-1-phenethyl-piperidin-4-yl)-phenol

Conditions
ConditionsYield
With pyridine; borane In ethanol at 25℃;71%
2-Benzylacrylic acid ethyl ester
20593-63-9

2-Benzylacrylic acid ethyl ester

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

C25H33NO3*ClH

C25H33NO3*ClH

Conditions
ConditionsYield
Stage #1: 2-Benzylacrylic acid ethyl ester; 3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol In toluene for 4h; Reflux;
Stage #2: With hydrogenchloride In ethanol; toluene at 20℃; pH=1;		34.7%
methyl 2-benzylacrylate
3070-71-1

methyl 2-benzylacrylate

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

(2S)-2-([(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl]methyl)-3-phenylpropanoic acid methyl ester hydrochloride

(2S)-2-([(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl]methyl)-3-phenylpropanoic acid methyl ester hydrochloride

Conditions
ConditionsYield
Stage #1: methyl 2-benzylacrylate; 3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol In toluene for 4h; Reflux;
Stage #2: With hydrogenchloride In methanol; toluene at 20℃; pH=1;		29.6%
3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

2-benzylacrylic acid butyl ester

2-benzylacrylic acid butyl ester

(2S)-2-([(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl]methyl)-3-phenylpropanoic acid butyl ester hydrochloride

(2S)-2-([(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl]methyl)-3-phenylpropanoic acid butyl ester hydrochloride

Conditions
ConditionsYield
Stage #1: 3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol; 2-benzylacrylic acid butyl ester In toluene for 4h; Reflux;
Stage #2: With hydrogenchloride In butan-1-ol at 20℃; pH=1;		24%
3-(2-thienyl)-propanoic acid chloride
5834-04-8

3-(2-thienyl)-propanoic acid chloride

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

1-[(3R,4R)-4-(3-Hydroxy-phenyl)-3,4-dimethyl-piperidin-1-yl]-3-thiophen-2-yl-propan-1-one

1-[(3R,4R)-4-(3-Hydroxy-phenyl)-3,4-dimethyl-piperidin-1-yl]-3-thiophen-2-yl-propan-1-one

Conditions
ConditionsYield
With triethylamine In N,N-dimethyl-formamide at 90℃; for 2h;
With N,N,N',N'-tetramethyl-1,8-diaminonaphthalene In N,N-dimethyl-formamide for 1h; Ambient temperature;
5-methylhexanoyl chloride
5699-78-5

5-methylhexanoyl chloride

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

1-[(3R,4R)-4-(3-Hydroxy-phenyl)-3,4-dimethyl-piperidin-1-yl]-5-methyl-hexan-1-one

1-[(3R,4R)-4-(3-Hydroxy-phenyl)-3,4-dimethyl-piperidin-1-yl]-5-methyl-hexan-1-one

Conditions
ConditionsYield
With N,N,N',N'-tetramethyl-1,8-diaminonaphthalene In N,N-dimethyl-formamide for 1h; Ambient temperature;
N-(2-benzoylethyl)-N,N,N-trimethylammonium iodide
5724-15-2

N-(2-benzoylethyl)-N,N,N-trimethylammonium iodide

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

(+)-1-(1-phenyl-1-oxoprop-3-yl)-3(R),4(R)-dimethyl-4-(3-hydroxyphenyl)piperidine

(+)-1-(1-phenyl-1-oxoprop-3-yl)-3(R),4(R)-dimethyl-4-(3-hydroxyphenyl)piperidine

Conditions
ConditionsYield
With sodium carbonate In N,N-dimethyl-formamide for 4h; Ambient temperature;
(-)-(1S)-1-(tert-Butyldimethylsiloxy)-1-cyclohexyl-3-hydroxypropane
132621-42-2

(-)-(1S)-1-(tert-Butyldimethylsiloxy)-1-cyclohexyl-3-hydroxypropane

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

3-{(3R,4R)-1-[(S)-3-(tert-Butyl-dimethyl-silanyloxy)-3-cyclohexyl-propyl]-3,4-dimethyl-piperidin-4-yl}-phenol

3-{(3R,4R)-1-[(S)-3-(tert-Butyl-dimethyl-silanyloxy)-3-cyclohexyl-propyl]-3,4-dimethyl-piperidin-4-yl}-phenol

Conditions
ConditionsYield
With sodium hydrogencarbonate; methanesulfonyl chloride; triethylamine 1) CH2Cl2, 0 deg C, 30 min, 2) DMF, reflux, 1 h; Multistep reaction;
3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

Hexanoyl chloride
142-61-0

Hexanoyl chloride

1-[(3R,4R)-4-(3-Hydroxy-phenyl)-3,4-dimethyl-piperidin-1-yl]-hexan-1-one

1-[(3R,4R)-4-(3-Hydroxy-phenyl)-3,4-dimethyl-piperidin-1-yl]-hexan-1-one

Conditions
ConditionsYield
With N,N,N',N'-tetramethyl-1,8-diaminonaphthalene In N,N-dimethyl-formamide for 1h; Ambient temperature;
3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

N,N,N-trimethyl-3-cyclohexyl-3-oxopropanaminium iodide

N,N,N-trimethyl-3-cyclohexyl-3-oxopropanaminium iodide

1-Cyclohexyl-3-[(3R,4R)-4-(3-hydroxy-phenyl)-3,4-dimethyl-piperidin-1-yl]-propan-1-one

1-Cyclohexyl-3-[(3R,4R)-4-(3-hydroxy-phenyl)-3,4-dimethyl-piperidin-1-yl]-propan-1-one

Conditions
ConditionsYield
With sodium carbonate In N,N-dimethyl-formamide for 3h; Ambient temperature;
2-Benzylacrylic acid ethyl ester
20593-63-9

2-Benzylacrylic acid ethyl ester

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

4-(3-hydroxyphenyl)-3(R),4(R)-dimethyl-2'(SR)-(phenylmethyl)-1-piperidinepropanoic acid ethyl ester

4-(3-hydroxyphenyl)-3(R),4(R)-dimethyl-2'(SR)-(phenylmethyl)-1-piperidinepropanoic acid ethyl ester

Conditions
ConditionsYield
In methanol for 240h; Ambient temperature;8.0 g
Benzofuran-2-carboxylic acid
496-41-3

Benzofuran-2-carboxylic acid

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

3-((3R,4R)-1-Benzofuran-2-ylmethyl-3,4-dimethyl-piperidin-4-yl)-phenol

3-((3R,4R)-1-Benzofuran-2-ylmethyl-3,4-dimethyl-piperidin-4-yl)-phenol

Conditions
ConditionsYield
With sodium dihydro-bis-(2-methoxyethoxy)aluminate; (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; triethylamine 1.) THF, RT, 1 h, 2.) THF, toluene, RT, 1 h; Yield given. Multistep reaction;
benzo[b]thiophene-2-carboxylic acid
6314-28-9

benzo[b]thiophene-2-carboxylic acid

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

3-((3R,4R)-1-Benzo[b]thiophen-2-ylmethyl-3,4-dimethyl-piperidin-4-yl)-phenol

3-((3R,4R)-1-Benzo[b]thiophen-2-ylmethyl-3,4-dimethyl-piperidin-4-yl)-phenol

Conditions
ConditionsYield
With sodium dihydro-bis-(2-methoxyethoxy)aluminate; (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; triethylamine 1.) THF, RT, 1 h, 2.) THF, toluene, RT, 1 h; Yield given. Multistep reaction;
(E)-3-phenylacrylic acid
140-10-3

(E)-3-phenylacrylic acid

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

RTI-5989-1

RTI-5989-1

Conditions
ConditionsYield
With sodium dihydro-bis-(2-methoxyethoxy)aluminate; (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; triethylamine 1.) THF, RT, 1 h, 2.) THF, toluene, RT, 1 h; Yield given. Multistep reaction;
cis-cinnamic acid
140-10-3, 621-82-9, 102-94-3

cis-cinnamic acid

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

3-[(3R,4R)-3,4-Dimethyl-1-((Z)-3-phenyl-allyl)-piperidin-4-yl]-phenol

3-[(3R,4R)-3,4-Dimethyl-1-((Z)-3-phenyl-allyl)-piperidin-4-yl]-phenol

Conditions
ConditionsYield
With sodium dihydro-bis-(2-methoxyethoxy)aluminate; (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; triethylamine 1.) THF, RT, 1 h, 2.) THF, toluene, RT, 1 h; Yield given. Multistep reaction;
(E)-3-(2-methylphenyl)acrylic acid
939-57-1, 2373-76-4, 41397-71-1

(E)-3-(2-methylphenyl)acrylic acid

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

RTI 5989-25

RTI 5989-25

Conditions
ConditionsYield
With sodium dihydro-bis-(2-methoxyethoxy)aluminate; (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; triethylamine 1.) THF, RT, 1 h, 2.) THF, toluene, RT, 1 h; Yield given. Multistep reaction;
trans-2-chlorocinnamic acid
704-96-1

trans-2-chlorocinnamic acid

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

RTI-5989-23

RTI-5989-23

Conditions
ConditionsYield
With sodium dihydro-bis-(2-methoxyethoxy)aluminate; (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; triethylamine 1.) THF, RT, 1 h, 2.) THF, toluene, RT, 1 h; Yield given. Multistep reaction;
(1S*,2R*)-2-phenylcyclopropane-1-carboxylic acid
939-89-9, 939-90-2, 3471-10-1, 5685-38-1, 23020-15-7, 23020-18-0, 42916-14-3, 48126-51-8, 67528-68-1, 111956-00-4, 111956-01-5

(1S*,2R*)-2-phenylcyclopropane-1-carboxylic acid

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

3-[(3R,4R)-3,4-Dimethyl-1-((1R,2S)-2-phenyl-cyclopropylmethyl)-piperidin-4-yl]-phenol

3-[(3R,4R)-3,4-Dimethyl-1-((1R,2S)-2-phenyl-cyclopropylmethyl)-piperidin-4-yl]-phenol

Conditions
ConditionsYield
With sodium dihydro-bis-(2-methoxyethoxy)aluminate; (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; triethylamine 1.) THF, RT, 1 h, 2.) THF, toluene, RT, 1 h; Yield given. Multistep reaction;
trans-2-phenylcyclopropane-1-carboxylic acid
939-90-2

trans-2-phenylcyclopropane-1-carboxylic acid

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

3-[(3R,4R)-3,4-Dimethyl-1-((1S,2S)-2-phenyl-cyclopropylmethyl)-piperidin-4-yl]-phenol

3-[(3R,4R)-3,4-Dimethyl-1-((1S,2S)-2-phenyl-cyclopropylmethyl)-piperidin-4-yl]-phenol

Conditions
ConditionsYield
With sodium dihydro-bis-(2-methoxyethoxy)aluminate; (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; triethylamine 1.) THF, RT, 1 h, 2.) THF, toluene, RT, 1 h; Yield given. Multistep reaction;
BOC-glycine
4530-20-5

BOC-glycine

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

{2-[(3R,4R)-4-(3-Hydroxy-phenyl)-3,4-dimethyl-piperidin-1-yl]-2-oxo-ethyl}-carbamic acid tert-butyl ester

{2-[(3R,4R)-4-(3-Hydroxy-phenyl)-3,4-dimethyl-piperidin-1-yl]-2-oxo-ethyl}-carbamic acid tert-butyl ester

Conditions
ConditionsYield
With TEA; (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate In tetrahydrofuran for 1h; Ambient temperature;
t-Boc-L-valine
13734-41-3

t-Boc-L-valine

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol
119193-19-0

3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

{(S)-1-[(3R,4R)-4-(3-Hydroxy-phenyl)-3,4-dimethyl-piperidine-1-carbonyl]-2-methyl-propyl}-carbamic acid tert-butyl ester

{(S)-1-[(3R,4R)-4-(3-Hydroxy-phenyl)-3,4-dimethyl-piperidine-1-carbonyl]-2-methyl-propyl}-carbamic acid tert-butyl ester

Conditions
ConditionsYield
With TEA; (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate In tetrahydrofuran for 1h; Ambient temperature;

(3R,4R)-3,4-Dimethyl-4-(3-hydroxyphenyl)piperidine Specification

The Phenol,3-[(3R,4R)-3,4-dimethyl-4-piperidinyl]-, with its CAS registry number 119193-19-0, has the systematic name of 3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol. With its molecular foumula of C13H19NO, it has the formula weight of 205.30. For being a kind of irritant chemical, it may cause inflammation to the skin or other mucous membranes. 

The characteristics of Phenol,3-[(3R,4R)-3,4-dimethyl-4-piperidinyl]- are as follows: (1)ACD/LogP: 2.44; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 32.26 Å2; (11)Index of Refraction: 1.522; (12)Molar Refractivity: 62.054 cm3; (13)Molar Volume: 203.515 cm3; (14)Polarizability: 24.6×10-24cm3; (15)Surface Tension: 37.753 dyne/cm; (16)Density: 1.009 g/cm3; (17)Flash Point: 115.716 °C; (18)Enthalpy of Vaporization: 60.146 kJ/mol; (19)Boiling Point: 335.464 °C at 760 mmHg.

What's more, the following datas could be converted into the molecular structure:
(1)SMILES:Oc1cccc(c1)[C@]2(C)CCNC[C@@H]2
(2)InChI:InChI=1/C13H19NO/c1-10-9-14-7-6-13(10,2)11-4-3-5-12(15)8-11/h3-5,8,10,14-15H,6-7,9H2,1-2H3/t10-,13+/m0/s1
(3)InChIKey:HXZDAOSDNCHKFE-GXFFZTMABP
(4)Std. InChI:InChI=1S/C13H19NO/c1-10-9-14-7-6-13(10,2)11-4-3-5-12(15)8-11/h3-5,8,10,14-15H,6-7,9H2,1-2H3/t10-,13+/m0/s1
(5)Std. InChIKey:HXZDAOSDNCHKFE-GXFFZTMASA-N

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