(1R)-3-Chloro-1-phenyl-propan-1-ol supplier

Name
(1R)-3-Chloro-1-phenyl-propan-1-ol
EINECS 627-168-3
CAS No. 100306-33-0
Article Data52
CAS DataBase
Density 1.149 g/cm³
Solubility
Melting Point 58-61 °C
Formula C₉H₁₁ClO
Boiling Point 296.4°C at 760 mmHg
Molecular Weight 170.639
Flash Point 132°C
Transport Information
Appearance off-white cryst
Safety 26-36
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms Benzenemethanol,α-(2-chloroethyl)-, (R)-;(+)-3-Chloro-1-phenyl-1-propanol;(R)-(+)-3-Chloro-1-phenyl-1-propanol;(R)-3-Chloro-1-phenyl-1-propanol;(R)-3-Chloro-1-phenyl-propanol;(R)-3-Chloro-1-phenylpropanol;
PSA 20.23000
LogP 2.34890

Synthetic route

: 936-59-4
3-chloropropiophenone

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

Conditions

Conditions	Yield
With borane; S-oxaborolidine In tetrahydrofuran at 0℃; for 0.833333h;	99%
With dichloro(pentamethylcyclopentadienyl)rhodium (III) dimer; C22H32N4O4S2; water; sodium formate at 40℃; for 0.25h; Air atmosphere; optical yield given as %ee; enantioselective reaction;	99%
With dichloro(pentamethylcyclopentadienyl)rhodium (III) dimer; (1R,2R)-9H-fluorene-2,7-disulfonic acid bis-[(2-amino-cyclohexyl)amide]; sodium formate In water at 40℃; for 0.25h; optical yield given as %ee; enantioselective reaction;	99%

: 936-59-4
3-chloropropiophenone

A: 100306-34-1
3-chloro-1-phenylpropanol

B: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

Conditions

Conditions	Yield
With dimethylsulfide borane complex; C23H22BNO3 In tetrahydrofuran at 20℃; for 2h; Reagent/catalyst;	A n/a B 75%
With dimethylsulfide borane complex; (+)-3-exo-amino-7,7-dimethoxynorbornan-2-exo-ol In tetrahydrofuran at 25℃; for 2h;	A 65% B n/a
With dimethylsulfide borane complex; chiral diphenyloxazaborolidine In tetrahydrofuran at 25℃; Yield given. Yields of byproduct given. Title compound not separated from byproducts;

: 108-22-5
Isopropenyl acetate

: 18776-12-0
3-chloro-1-phenyl-propan-1-ol

A: 100306-34-1
3-chloro-1-phenylpropanol

B: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

C: (R)-3-chloro-1-phenyl-1-propyl acetate

Conditions

Conditions	Yield
With Pseudomonas cepacia lipase immobilized on toyonite; potassium tert-butylate; sodium carbonate; [2,3,4,5-Ph4(η5-C4CNH(i-Pr))]Ru(CO)2Cl In toluene at 25℃; for 168h;	A n/a B n/a C 31%
With Burkholderia species lipoprotein lipase; C51H77NO17; dextrin In toluene at 25℃; for 6h; Enzymatic reaction; enantioselective reaction;	A n/a B n/a C n/a

...Expand

: 108-05-4
vinyl acetate

: 18776-12-0
3-chloro-1-phenyl-propan-1-ol

A: 100306-34-1
3-chloro-1-phenylpropanol

B: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

C: (R)-3-chloro-1-phenyl-1-propyl acetate

Conditions

Conditions	Yield
With lipase from Pseudomonas fluorescens In hexane at 20℃; for 21h; Resolution of racemate; Enzymatic reaction; optical yield given as %ee; enantioselective reaction;	A n/a B n/a C 25%

...Expand

: (R)-3-chloro-1-phenyl-1-propyl acetate

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

Conditions

Conditions	Yield
With lipase from Candida rugosa at 20℃; for 5h; pH=8; aq. phosphate buffer; Enzymatic reaction; stereoselective reaction;	23%

: Phenyl-acetic acid 3-chloro-1-phenyl-propyl ester

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

Conditions

Conditions	Yield
In acetonitrile at 27 - 28℃; 0.1 M aq. phosphate buffer (pH 8.0), penicillin G aminohydrolase (PGA);	18%

: 141987-54-4
1-Phenyl-3-chlor-propyl-monochloracetat

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

Conditions

Conditions	Yield
With buffer pH 7 lipase from Pseudomonas fluorescens (SAM-2);

: 141987-54-4
1-Phenyl-3-chlor-propyl-monochloracetat

A: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

B: 142037-19-2
Chloro-acetic acid (S)-3-chloro-1-phenyl-propyl ester

Conditions

Conditions	Yield
pH 7, Pseudomonas sp. lipase (SAM-2);

: 293322-40-4
3-Cloro-1-phenylpropyl butanoate

A: 100306-34-1
3-chloro-1-phenylpropanol

B: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

Conditions

Conditions	Yield
With phosphate buffer; novozyme 435 at 30℃; for 288h; pH=7; Hydrolysis; Title compound not separated from byproducts;

: 936-59-4
3-chloropropiophenone

A: 93-54-9
1-Phenyl-1-propanol

B: 100306-34-1
3-chloro-1-phenylpropanol

C: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

D: 93-55-0
1-phenyl-propan-1-one

Conditions

Conditions	Yield
With Merulius tremellosus ono991 In acetone at 28℃; for 72h; Title compound not separated from byproducts;

...Expand

: 18776-12-0
3-chloro-1-phenyl-propan-1-ol

A: 936-59-4
3-chloropropiophenone

B: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

Conditions

Conditions	Yield
With Sphingomonas paucimobilis NCIMB 8195 In water; N,N-dimethyl-formamide for 120h;	A 21 % Chromat. B 79 % Chromat.

: 18776-12-0
3-chloro-1-phenyl-propan-1-ol

: 97-72-3
2-Methylpropionic anhydride

A: 100306-34-1
3-chloro-1-phenylpropanol

B: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

C: Isobutyric acid (S)-3-chloro-1-phenyl-propyl ester

D: (1R)-3-chloro-1-phenylpropyl 2-methylpropanoate

Conditions

Conditions	Yield
With (-)-(Sa) 4-di-n-butylaminopyridine based biaryl; triethylamine In toluene at -95℃; for 15h; Title compound not separated from byproducts.;

...Expand

: 18776-12-0
3-chloro-1-phenyl-propan-1-ol

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 93 percent / pyridine; DMAP / CH2Cl2 / 0 - 20 °C 2: aq. phosphate buffer; Novozyme 435 / 288 h / 30 °C / pH 7 View Scheme
Multi-step reaction with 2 steps 1: pyridine / CH2Cl2 2: buffer pH 7 / lipase from Pseudomonas fluorescens (SAM-2) View Scheme

: 18776-12-0
3-chloro-1-phenyl-propan-1-ol

A: 100306-34-1
3-chloro-1-phenylpropanol

B: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

Conditions

Conditions	Yield
at 145 - 180℃; Gas phase; Resolution of racemate; Inert atmosphere;
With Candida antarctica lipase B (Novozym 435) at 45℃; under 150 Torr; for 144h; Resolution of racemate; Enzymatic reaction; Overall yield = 58 %;	A n/a B n/a
Stage #1: 3-chloro-1-phenyl-propan-1-ol With Candida antarctica lipase B (Novozym 435) at 45℃; under 150 Torr; for 144h; Resolution of racemate; Enzymatic reaction; Stage #2: With ethanol; Candida antarctica lipase B (Novozym 435) for 24h; Enzymatic reaction; Overall yield = 33 %;	A n/a B n/a

: 22912-90-9
(RS)-3-chloro-1-phenyl-1-propyl acetate

A: 100306-34-1
3-chloro-1-phenylpropanol

B: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

C: (S)-3-chloro-1-phenyl-1-propyl acetate

D: (R)-3-chloro-1-phenyl-1-propyl acetate

Conditions

Conditions	Yield
With Bacillus subtilis esterase In ethanol at 30℃; for 12h; pH=7.2; aq. phosphate buffer; optical yield given as %ee; enantioselective reaction;

...Expand

: 936-59-4
3-chloropropiophenone

A: 613-87-6
(S)-1-phenyl-1-propanol

B: 100306-34-1
3-chloro-1-phenylpropanol

C: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

D: 93-55-0
1-phenyl-propan-1-one

Conditions

Conditions	Yield
With yeast strain Aureobasidium pullulans CQA at 28℃; for 48h; Microbiological reaction; Enzymatic reaction;	A n/a B n/a C n/a D n/a
With yeast culture of Candida viswanathii KCh 120 In acetone at 25℃; for 6h; Microbiological reaction; enantioselective reaction;	A 30 %Chromat. B n/a C n/a D 23 %Chromat.

...Expand

: 936-59-4
3-chloropropiophenone

A: 1565-74-8
(R)-1-phenyl-1-propanol

B: 613-87-6
(S)-1-phenyl-1-propanol

C: 100306-34-1
3-chloro-1-phenylpropanol

D: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

E: 93-55-0
1-phenyl-propan-1-one

Conditions

Conditions	Yield
With yeast culture of Aphanocladium album KCh 417 In acetone at 25℃; for 144h; Microbiological reaction; enantioselective reaction;	A n/a B n/a C n/a D n/a E 21 %Chromat.
With yeast culture of Saccharomyces cerevisiae KCh 464 In acetone at 25℃; for 144h; Microbiological reaction; enantioselective reaction;	A n/a B n/a C n/a D n/a E 33 %Chromat.
With yeast culture of Saccharomyces pastorianus KCh 906 In acetone at 25℃; for 24h; Reagent/catalyst; Microbiological reaction; enantioselective reaction;	A n/a B n/a C n/a D n/a E 33 %Chromat.

...Expand

: 936-59-4
3-chloropropiophenone

A: 1565-74-8
(R)-1-phenyl-1-propanol

B: 100306-34-1
3-chloro-1-phenylpropanol

C: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

D: 93-55-0
1-phenyl-propan-1-one

Conditions

Conditions	Yield
With yeast culture of Candida parapsilosis KCh 909 In acetone at 25℃; for 72h; Microbiological reaction; enantioselective reaction;	A 29 %Chromat. B n/a C n/a D 33 %Chromat.
With yeast culture of Candida viswanathii KCh 120 In acetone at 25℃; for 144h; Microbiological reaction; enantioselective reaction;	A 28 %Chromat. B n/a C n/a D 57 %Chromat.

...Expand

: 936-59-4
3-chloropropiophenone

A: 100306-34-1
3-chloro-1-phenylpropanol

B: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

C: 93-55-0
1-phenyl-propan-1-one

Conditions

Conditions	Yield
With yeast culture of Saccharomyces brasiliensis KCh 905 In acetone at 25℃; for 24h; Microbiological reaction; enantioselective reaction;	A n/a B n/a C 61 %Chromat.

...Expand

: C15H22BClO3

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

Conditions

Conditions	Yield
With silica gel In toluene at 20℃; for 1h; Schlenk technique; Glovebox;

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

NaI: NaI

: 127073-84-1
(R)-3-iodo-1-phenyl-1-propanol

Conditions

Conditions	Yield
In acetone for 16h; Heating;	99%

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 127073-84-1
(R)-3-iodo-1-phenyl-1-propanol

Conditions

Conditions	Yield
With sodium iodide In acetone for 16h; Reflux; enantioselective reaction;	99%
With sodium iodide In acetone for 16h; Finkelstein Reaction; Heating / reflux;	98%
With sodium iodide In acetone for 16h; Reflux;	91%
With sodium iodide
With sodium iodide In acetone

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 168465-69-8
(R)-α-(2-azidoethyl)benzenemethanol

Conditions

Conditions	Yield
With sodium azide In N,N-dimethyl-formamide at 25℃; for 18h;	99%
With sodium azide	99%
In dimethyl sulfoxide	79%
With sodium azide In dimethyl sulfoxide at 40℃; for 1.5h;	79%
Multi-step reaction with 2 steps 1: NaI 2: NaN3 View Scheme

: 123-08-0
4-hydroxy-benzaldehyde

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: (R)-4-(3-hydroxy-3-phenylpropoxy)benzaldehyde

Conditions

Conditions	Yield
Stage #1: 4-hydroxy-benzaldehyde With caesium carbonate In tetrahydrofuran; N,N-dimethyl-formamide at 50℃; for 1h; Stage #2: (1R)-3-chloro-1-phenylpropanol In tetrahydrofuran; N,N-dimethyl-formamide at 50℃; for 16h; Inert atmosphere;	95%
With potassium carbonate In tetrahydrofuran; N,N-dimethyl-formamide at 50℃;

: 387827-32-9
2-methyl-N-[3-(4-piperidinyl)phenyl]propanamide

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 387826-71-3
N-(3-{1-[(3R)-3-HYDROXY-3-PHENYLPROPYL]-4-PIPERIDINYL}PHENYL)-2-METHYLPROPANAMIDE

Conditions

Conditions	Yield
With potassium carbonate; sodium iodide In DMF (N,N-dimethyl-formamide) at 100℃; for 3h;	94.3%
With N-ethyl-N,N-diisopropylamine; tetra-(n-butyl)ammonium iodide In 1,4-dioxane	34.2%
With N-ethyl-N,N-diisopropylamine; tetra-(n-butyl)ammonium iodide In 1,4-dioxane	34.2%
With N-ethyl-N,N-diisopropylamine; tetra-(n-butyl)ammonium iodide In 1,4-dioxane at 90℃; for 72h;	34.2%

: 626-02-8
3-Iodophenol

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: (R)-1-(3-chloro-1-phenylpropoxy)-3-iodobenzene

Conditions

Conditions	Yield
With di-isopropyl azodicarboxylate; triphenylphosphine In tetrahydrofuran at 0 - 20℃; for 20h; Mitsunobu Displacement;	89%

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: (Z)-diphenyl[(Z)-2-phenyl-2-(phenylsulfonyl)vinyl]selenonium trifluoromethanesulfonate

: (Z)-β-[(1R)-3-chloro-1-phenylpropoxy]-α-(phenylsulfonyl)styrene

Conditions

Conditions	Yield
With sodium hydride In acetonitrile at -30℃; for 2h; Substitution;	88%

: 3-(4-hydroxynaphthalen-1-yl)-1-phenylpropan-1-one

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: C28H26O3

Conditions

Conditions	Yield
With 1,8-diazabicyclo[5.4.0]undec-7-ene In N,N-dimethyl-formamide at 70℃; for 5h;	87%

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 106760-61-6
(R)-(+)-2-Phenyloxetane

Conditions

Conditions	Yield
With potassium tert-butylate In tetrahydrofuran at 25℃; for 4h;	86%
With potassium tert-butylate In tetrahydrofuran for 4h;	82%
With potassium tert-butylate In tetrahydrofuran at 20℃; for 12h; Schlenk technique; Glovebox; enantioselective reaction;	81%
With potassium hydride In tetrahydrofuran at 0 - 20℃; for 15h;	76%
With potassium tert-butylate In tetrahydrofuran

: 110-91-8
morpholine

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 40116-81-2
(R)-3-morpholino-1-phenylpropan-1-ol

Conditions

Conditions	Yield
at 80℃;	86%
at 80℃;

: 90-15-3
α-naphthol

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: (R)-(-)-3-(1-naphthalenyloxy)-1-phenyl-1-propanol

Conditions

Conditions	Yield
With sodium hydroxide In N,N-dimethyl acetamide at 60 - 80℃;	85.6%
Stage #1: α-naphthol With sodium hydride In N,N-dimethyl-formamide for 1h; Cooling with ice; Stage #2: (1R)-3-chloro-1-phenylpropanol In N,N-dimethyl-formamide for 1h; Cooling with ice;	74%
With sodium hydroxide In water; N,N-dimethyl-formamide; toluene at 90 - 95℃; for 2h; Large scale reaction;	67.2%
With potassium hydroxide In acetone at 0℃; Inert atmosphere; Reflux;

: 6627-55-0
2-bromo-p-cresol

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: (S)-2-bromo-1-(3-chloro-1-phenylpropoxy)-4-methyl-benzene

Conditions

Conditions	Yield
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran at 20℃; Mitsunobu reaction;	82%
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran at 20℃; Mitsunobu reaction;	82%

: 36016-38-3
tert-Butyl N-hydroxycarbamate

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: tert-butyl N-[(3R)-3-hydroxy-3-phenylpropoxy]carbamate

Conditions

Conditions	Yield
Stage #1: tert-Butyl N-hydroxycarbamate With sodium hydride In N,N-dimethyl-formamide at 0℃; for 0.333333h; Inert atmosphere; Stage #2: (1R)-3-chloro-1-phenylpropanol In N,N-dimethyl-formamide at 0 - 20℃; for 72h; Inert atmosphere;	82%
Stage #1: tert-Butyl N-hydroxycarbamate With sodium hydride In N,N-dimethyl-formamide at 0℃; for 0.5h; Stage #2: (1R)-3-chloro-1-phenylpropanol In N,N-dimethyl-formamide at 0 - 20℃; for 72h;	68%
Stage #1: tert-Butyl N-hydroxycarbamate With sodium hydride In N,N-dimethyl-formamide at 0℃; for 0.5h; Stage #2: (1R)-3-chloro-1-phenylpropanol In N,N-dimethyl-formamide at 0 - 20℃; for 72h;

: 695-96-5
2-bromo-4-chlorophenol

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: (S)-2-bromo-4-chloro-1-(3-chloro-1-phenylpropoxy)-benzene

Conditions

Conditions	Yield
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran at 20℃; Mitsunobu reaction;	81%
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran at 20℃; Mitsunobu reaction;	81%

: 615-58-7
2,4-dibromophenol

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 319924-81-7
(S)-2,4-dibromo-1-(3-chloro-1-phenylpropoxy)-benzene

Conditions

Conditions	Yield
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran at 20℃; Mitsunobu reaction;	79%

: 95-56-7
2-hydroxybromobenzene

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 319924-80-6
(S)-1-bromo-2-(3-chloro-1-phenylpropoxy)-benzene

Conditions

Conditions	Yield
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran at 20℃; Mitsunobu reaction;	78%
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran at 20℃; Mitsunobu reaction;	78%

: 608-33-3
2,6-dibromophenol

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 319924-93-1
(S)-2,6-dibromo-1-(3-chloro-1-phenylpropoxy)-benzene

Conditions

Conditions	Yield
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran at 20℃; Mitsunobu reaction;	77%

: 121449-70-5
2-bromo-3,5-dimethoxyphenol

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: (S)-2-bromo-1-(3-chloro-1-phenylpropoxy)-3,5-dimethoxy-benzene

Conditions

Conditions	Yield
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran at 20℃; Mitsunobu reaction;	76%
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran at 20℃; Mitsunobu reaction;	76%

: 121-71-1
3-Hydroxyacetophenone

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 487058-12-8
1-(3-{[(1S)-3-chloro-1-phenylpropyl]oxy}phenyl)ethanone

Conditions

Conditions	Yield
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran	76%

: 831-82-3
4-Phenoxyphenol

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 387827-50-1
4-{[(1S)-3-chloro-1-phenylpropyl]oxy}-(4-phenoxy)benzene

Conditions

Conditions	Yield
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran at 20℃; for 24h;	75.7%

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 100-46-9
benzylamine

: 185376-75-4
(R)-3-(benzylamino)-1-phenylpropan-1-ol

Conditions

Conditions	Yield
With potassium carbonate; potassium iodide In acetonitrile at 75℃; for 48h;	75%

: 136918-14-4
phthalimide

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 387827-49-8
2-[(1S)-3-chloro-1-phenylpropyl]-1H-isoindole-1,3(2H)-dione

Conditions

Conditions	Yield
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran at 20℃; for 4h;	74%
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran at 20℃; for 24h;	50.2%

: 136918-14-4
phthalimide

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 1972-28-7
diethylazodicarboxylate

: 387827-49-8
2-[(1S)-3-chloro-1-phenylpropyl]-1H-isoindole-1,3(2H)-dione

Conditions

Conditions	Yield
With triphenylphosphine In tetrahydrofuran; hexane; ethyl acetate	74%

...Expand

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 74-89-5
methylamine

: 115290-81-8
(R)-N-methyl-3-phenyl-3-hydroxypropylamine

Conditions

Conditions	Yield
With potassium iodide In methanol; water at 80℃; for 8h;	72%
With sodium iodide In water

: 95-48-7
ortho-cresol

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 114446-50-3
-(+)-1-chloro-3-phenyl-3-(2-methylphenoxy)propane

Conditions

Conditions	Yield
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran Ambient temperature;	68%
With triphenylphosphine; diethylazodicarboxylate In diethyl ether
With triphenylphosphine; diethylazodicarboxylate
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran Ambient temperature;

: 402-45-9
4-hydroxybenzotrifluoride

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 114446-51-4
-(-)-1-chloro-3-phenyl-3-<4-(trifluoromethyl)phenoxy>propane

Conditions

Conditions	Yield
Stage #1: 4-hydroxybenzotrifluoride With di-isopropyl azodicarboxylate; triphenylphosphine In tetrahydrofuran at 20℃; for 4h; Mitsunobu reaction; Inert atmosphere; Stage #2: (1R)-3-chloro-1-phenylpropanol In tetrahydrofuran at 20℃; Mitsunobu reaction; Inert atmosphere;	66%
With triphenylphosphine; diethylazodicarboxylate

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 402-45-9
α,α,α-trifluoro-p-cresol

: 114446-51-4
-(-)-1-chloro-3-phenyl-3-<4-(trifluoromethyl)phenoxy>propane

Conditions

Conditions	Yield
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran Ambient temperature;	65%

: 100306-33-0
(1R)-3-chloro-1-phenylpropanol

: 319924-91-9
2-bromo-5,6,7,8-tetrahydronaphthalen-1-ol

: 6-Bromo-5-((S)-3-chloro-1-phenyl-propoxy)-1,2,3,4-tetrahydro-naphthalene

Conditions

Conditions	Yield
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran at 20℃; Mitsunobu reaction;	64%

(1R)-3-Chloro-1-phenyl-propan-1-ol Specification

This chemical has the IUPAC name (1R)-3-Chloro-1-phenyl-propan-1-ol. With the CAS registry number 100306-33-0, it is also known as Benzenemethanol, α-(2-chloroethyl)-, (αR)-. Its molecular formula is C₉H₁₁ClO and its product categories are Chiral; Amino Acid Derivatives. However, this chemical which is off-white cryst should be kept cool and dry, away from the oxides.

Other characteristics of the (1R)-3-Chloro-1-phenyl-propan-1-ol can be summarised as followings: (1)ACD/LogP: 2.20; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.2; (4)ACD/LogD (pH 7.4): 2.2; (5)ACD/BCF (pH 5.5): 27.44; (6)ACD/BCF (pH 7.4): 27.44; (7)ACD/KOC (pH 5.5): 372.6; (8)ACD/KOC (pH 7.4): 372.6; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.543; (14)Molar Refractivity: 46.82 cm³; (15)Molar Volume: 148.3 cm³; (16)Polarizability: 18.56×10^-24cm³; (17)Surface Tension: 41.8 dyne/cm; (18)Density: 1.149 g/cm³; (19)Flash Point: 132 °C; (20)Enthalpy of Vaporization: 56.62 kJ/mol; (21)Boiling Point: 296.4 °C at 760 mmHg; (22)Vapour Pressure: 0.000651 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: ClCC[C@@H](O)c1ccccc1
2.InChI: InChI=1/C9H11ClO/c10-7-6-9(11)8-4-2-1-3-5-8/h1-5,9,11H,6-7H2/t9-/m1/s1
3.InChIKey: JZFUHAGLMZWKTF-SECBINFHBM

Product Name

(1R)-3-Chloro-1-phenyl-propan-1-ol

Synthetic route

(1R)-3-Chloro-1-phenyl-propan-1-ol Specification

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