tert-Butyl 3-methyl-4-oxopiperidine-1-carboxylate supplier

Name
1-BOC-3-METHYL-PIPERIDIN-4-ONE
EINECS
CAS No. 181269-69-2
Article Data27
CAS DataBase
Density 1.06 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₉NO₃
Boiling Point 298.758 °C at 760 mmHg
Molecular Weight 213.277
Flash Point 134.485 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-tert-Butoxycarbonyl-3-methyl-4-piperidone;3-Methyl-4-oxopiperidine-1-carboxylic acid tert-butyl ester;N-tert-Butoxycarbonyl-3-methyl-4-piperidone;tert-Butyl3-methyl-4-oxo-1-piperidinecarboxylate;
PSA 46.61000
LogP 1.77030

Synthetic route

: 34737-89-8
1-Benzyl-3-methyl-4-piperidon

: 24424-99-5
di-tert-butyl dicarbonate

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

Conditions

Conditions	Yield
With hydrogen; palladium dihydroxide In ethyl acetate under 2068.65 Torr; for 24h;	100%
With hydrogen; palladium 10% on activated carbon In ethanol at 20℃; under 2585.81 Torr; for 4h;	97%
With hydrogen; palladium(II) hydroxide In methanol at 20℃; under 2844.39 Torr;	95%

: 79099-07-3
N-tert-butyloxycarbonylpiperidin-4-one

: 74-88-4
methyl iodide

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

Conditions

Conditions	Yield
Stage #1: N-tert-butyloxycarbonylpiperidin-4-one With lithium diisopropyl amide In tetrahydrofuran at -78℃; for 0.5h; Inert atmosphere; Stage #2: methyl iodide In tetrahydrofuran at -78 - 20℃; for 3h;	45%
Stage #1: N-tert-butyloxycarbonylpiperidin-4-one With lithium diisopropyl amide In tetrahydrofuran at -78℃; for 1h; Inert atmosphere; Stage #2: methyl iodide In tetrahydrofuran at 20℃; for 3h;	28%
Stage #1: N-tert-butyloxycarbonylpiperidin-4-one With potassium hexamethylsilazane In tetrahydrofuran; toluene at 20℃; for 2h; Stage #2: methyl iodide In tetrahydrofuran; toluene at 20℃;	22.5%
Stage #1: N-tert-butyloxycarbonylpiperidin-4-one With sodium hydride In tetrahydrofuran; mineral oil at 20℃; Stage #2: methyl iodide In tetrahydrofuran; mineral oil	16%
Stage #1: N-tert-butyloxycarbonylpiperidin-4-one With sodium hydride In tetrahydrofuran at 20℃; for 0.5h; Stage #2: methyl iodide In tetrahydrofuran at 20℃; for 18h;	10%

: 5773-58-0
3-methyl-4-piperidone

: 24424-99-5
di-tert-butyl dicarbonate

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

Conditions

Conditions	Yield
With N,N-dimethylethylenediamine In dichloromethane at 20℃; for 2.5h;
With dmap; triethylamine In tetrahydrofuran; water at 20℃; for 18h;

: 24424-99-5
di-tert-butyl dicarbonate

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

Conditions

Conditions	Yield
Stage #1: 1-Benzyl-3-methyl-4-piperidon With hydrogenchloride; hydrogen; palladium dihydroxide In 1,4-dioxane; methanol under 2585.81 Torr; Stage #2: di-tert-butyl dicarbonate With triethylamine In tetrahydrofuran for 2h;

: 24424-99-5
di-tert-butyl dicarbonate

: 1159982-52-1
C14H23NO5

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

Conditions

Conditions	Yield
Stage #1: C14H23NO5 With hydrogenchloride In water for 48h; Reflux; Stage #2: di-tert-butyl dicarbonate With sodium carbonate In tetrahydrofuran; water

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 181269-70-5
tert-Butyl 4-hydroxy-3-methylpiperidine-1-carboxylate

Conditions

Conditions	Yield
With sodium tetrahydroborate In methanol at 0 - 20℃; for 3.5h;	100%
With methanol; sodium tetrahydroborate at 0 - 25℃; for 3.5h;	100%
With sodium tetrahydroborate In ethanol at 0℃; for 0.5h;	88%

: 37595-74-7
N,N-phenylbistrifluoromethane-sulfonimide

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 1240971-20-3
3-methyl-4-trifluoromethanesulfonyloxy-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester

Conditions

Conditions	Yield
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate With lithium hexamethyldisilazane In tetrahydrofuran at -78℃; for 1.5h; Stage #2: N,N-phenylbistrifluoromethane-sulfonimide In tetrahydrofuran at -78 - 25℃; for 2.5h;	97%
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate With sodium hexamethyldisilazane In tetrahydrofuran at -78℃; for 1.5h; Stage #2: N,N-phenylbistrifluoromethane-sulfonimide In tetrahydrofuran at 20℃; for 16h;	78%
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate With lithium hexamethyldisilazane In tetrahydrofuran at -78℃; for 0.5h; Inert atmosphere; Stage #2: N,N-phenylbistrifluoromethane-sulfonimide In tetrahydrofuran at -78 - 0℃; for 1h;	61%
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate With lithium diisopropyl amide In tetrahydrofuran at -78℃; for 0.666667h; Stage #2: N,N-phenylbistrifluoromethane-sulfonimide In tetrahydrofuran at -78 - 25℃; for 3h;	198 mg
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate With lithium hexamethyldisilazane In tetrahydrofuran at -70℃; for 1h; Inert atmosphere; Stage #2: N,N-phenylbistrifluoromethane-sulfonimide In tetrahydrofuran at -70 - 0℃; for 4h;

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: (S)-2-(2-(methylsulfonyl)ethyl)pyrrolidine hydrochloride

: C13H26N2O2S*ClH

Conditions

Conditions	Yield
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate; (S)-2-(2-(methylsulfonyl)ethyl)pyrrolidine hydrochloride With sodium tris(acetoxy)borohydride In 1,2-dichloro-ethane at 20℃; for 6h; Stage #2: With hydrogenchloride In 1,4-dioxane; dichloromethane at 20℃; for 4h;	96%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 1191250-62-0
diethyl {3-[(5-chloropyridin-2-yl)oxy]benzyl}phosphonate

: 5-chloro-2-{3-[(3-methylpiperidin-4-ylidene)methyl]phenoxy}pyridine

Conditions

Conditions	Yield
With potassium tert-butylate In tetrahydrofuran at 20℃; for 2h;	90%
With potassium tert-butylate In tetrahydrofuran at 20℃; for 2h;

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 180149-25-1
2-(5-methoxy-2-nitrophenyl)-ethylamine

: 1146733-30-3
tert-butyl 4-[2-(5-methoxy-2-nitro-phenyl)-ethylamino]-3-methyl-piperidine-1-carboxylate

Conditions

Conditions	Yield
With sodium tris(acetoxy)borohydride; acetic acid In dichloromethane at 20℃; for 3h;	90%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 1774-47-6
trimethylsulfoxonium iodide

: tert-butyl 4-methyl-1-oxa-6-azaspiro[2.5]octane-6-carboxylate

Conditions

Conditions	Yield
With potassium tert-butylate In 1,2-dimethoxyethane; dimethyl sulfoxide at 0 - 5℃; for 1h;	90%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 100-58-3
phenylmagnesium bromide

: tert-butyl 4-hydroxy-3-methyl-4-phenylpiperidine-1-carboxylate

Conditions

Conditions	Yield
In tetrahydrofuran at 0 - 20℃; for 24h;	84%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 1779-49-3
Methyltriphenylphosphonium bromide

: 336182-47-9
tert-butyl 3-methyl-4-methylidenepiperidine-1-carboxylate

Conditions

Conditions	Yield
Stage #1: Methyltriphenylphosphonium bromide With n-butyllithium In tetrahydrofuran at 0℃; Stage #2: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate In tetrahydrofuran at 20℃; for 1h;	83%
Stage #1: Methyltriphenylphosphonium bromide With potassium tert-butylate In tetrahydrofuran at 20℃; for 0.5h; Inert atmosphere; Stage #2: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate In tetrahydrofuran at 20℃; for 18h; Inert atmosphere;	60%
With potassium tert-butylate In dimethyl sulfoxide at 20℃; for 16h;

: 106-39-8
bromochlorobenzene

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 4-(4-chloro-phenyl)-4-hydroxy-3-methyl-piperidine-1-carboxylic acid tert-butyl ester

Conditions

Conditions	Yield
Stage #1: bromochlorobenzene With n-butyllithium In tetrahydrofuran; hexane at -78℃; Stage #2: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate In tetrahydrofuran; hexane at -78 - -20℃; Stage #3: With ammonium chloride In tetrahydrofuran; hexane; water	83%
Stage #1: bromochlorobenzene With n-butyllithium In tetrahydrofuran; hexanes at -78℃; for 0.75h; Stage #2: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate In tetrahydrofuran; hexanes at -78℃; for 2h;	79%

: 867-13-0
diethoxyphosphoryl-acetic acid ethyl ester

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 124-41-4
sodium methylate

: 502609-65-6
4-methoxycarbonylmethylene-3-methylpiperidine-1-carboxylic acid t-butyl ester

Conditions

Conditions	Yield
In tetrahydrofuran; methanol at 20℃; for 4h;	82.5%

...Expand

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 900642-17-3
tert-butyl 4-amino-3-methylpiperidine-1-carboxylate

Conditions

Conditions	Yield
With ammonium formate; sodium cyanoborohydride In methanol at 30℃; for 16h; Temperature; Molecular sieve;	80%
With ammonium formate; sodium cyanoborohydride In methanol at 20℃; for 3h; Molecular sieve;	60%
With formic acid; ammonium formate; sodium cyanoborohydride In methanol at 20℃; for 2h;

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 1020325-38-5
2-[3-(diethoxyphosphorylmethyl)phenoxy]-5-(trifluoromethyl)pyridine

: 1191288-06-8
2-{3-[(3-methylpiperidin-4-ylidene)methyl]phenoxy}-5-(trifluoromethyl)pyridine

Conditions

Conditions	Yield
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate; 2-[3-(diethoxyphosphorylmethyl)phenoxy]-5-(trifluoromethyl)pyridine With potassium tert-butylate In tetrahydrofuran at 20℃; for 1h; Stage #2: With trifluoroacetic acid In dichloromethane at 20℃; for 1h;	79%
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate; 2-[3-(diethoxyphosphorylmethyl)phenoxy]-5-(trifluoromethyl)pyridine With potassium tert-butylate In tetrahydrofuran at 20℃; for 1h; Stage #2: With trifluoroacetic acid In dichloromethane at 20℃; for 1h;	79%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 5773-58-0
3-methyl-4-piperidone

Conditions

Conditions	Yield
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate With trifluoroacetic acid In dichloromethane at 20℃; for 1h; Stage #2: With water In dichloromethane; water	75%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 1774-47-6
trimethylsulfoxonium iodide

: 862669-17-8
1,1-dimethylethyl 4-methyl-1-oxa-6-azaspiro[2.5]octane-6-carboxylate

Conditions

Conditions	Yield
Stage #1: trimethylsulfoxonium iodide With sodium hydride In dimethyl sulfoxide; mineral oil at 0 - 20℃; for 2h; Stage #2: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate In dimethyl sulfoxide; mineral oil at 0 - 20℃; for 2h;	75%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 689303-75-1
methyl (S)-3-(pyrrolidin-2-yl)propanoate

: tert-butyl 4-((S)-2-(3-methoxy-3-oxopropyl)pyrrolidin-1-yl)-3-methylpiperidine-1-carboxylate

Conditions

Conditions	Yield
With sodium tris(acetoxy)borohydride; acetic acid In dichloromethane at 20℃; for 16h;	75%
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate; methyl (S)-3-(pyrrolidin-2-yl)propanoate In 1,2-dichloro-ethane at 20℃; for 0.5h; Stage #2: With sodium tris(acetoxy)borohydride In 1,2-dichloro-ethane at 20℃;	37%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 1020326-79-7
Diethyl 3-(5-bromopyridin-2-yloxy)benzylphosphonate

: 1191250-55-1
5-bromo-2-{3-[(3-methylpiperidin-4-ylidene)methyl]phenoxy}pyridine

Conditions

Conditions	Yield
With potassium tert-butylate In tetrahydrofuran at 20℃; for 2h;	72%
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate; Diethyl 3-(5-bromopyridin-2-yloxy)benzylphosphonate With potassium tert-butylate In tetrahydrofuran at 20℃; for 2h; Stage #2: With trifluoroacetic acid In dichloromethane at 20℃; for 1h;	72%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 1449-46-3
benzyltriphenylphosphonium bromide

: tert-butyl 4-benzylidene-3-methylpiperidine-1-carboxylate

Conditions

Conditions	Yield
Stage #1: benzyltriphenylphosphonium bromide With potassium tert-butylate In tetrahydrofuran at 20℃; for 1h; Stage #2: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate In tetrahydrofuran at 20℃; for 3h;	63%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 7341-96-0
2-propynamide

: 1401034-50-1
tert-butyl 8-methyl-2-oxo-1,2,7,8-tetrahydro-1,6-naphthyridine-6(5H)-carboxylate

Conditions

Conditions	Yield
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate With pyrrolidine In toluene for 5h; Reflux; Stage #2: 2-propynamide In toluene Reflux;	55%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 5697-44-9
p-tolylsulfonylmethyl isocyanide

: tert-butyl 4-cyano-3-methylpiperidine-1-carboxylate

Conditions

Conditions	Yield
With potassium tert-butylate In 1,2-dimethoxyethane at 0 - 25℃; for 16h; Inert atmosphere;	50.4%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 145100-51-2
N-(5-chloropyridin-2-yl)-1,1,1-trifluoro-N-[(trifluoromethyl)sulphonyl]methanesulphonamide

: 1240971-20-3
3-methyl-4-trifluoromethanesulfonyloxy-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester

Conditions

Conditions	Yield
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate With potassium hexamethylsilazane In tetrahydrofuran at -78 - 20℃; for 3.5h; Stage #2: N-(5-chloropyridin-2-yl)-1,1,1-trifluoro-N-[(trifluoromethyl)sulphonyl]methanesulphonamide In tetrahydrofuran at -78 - 20℃;	47%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 95-92-1
oxalic acid diethyl ester

: tert-butyl 3-(2-ethoxy-2-oxoacetyl)-5-methyl-4-oxopiperidine-1-carboxylate

Conditions

Conditions	Yield
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate With lithium diisopropyl amide In tetrahydrofuran at -78℃; for 1h; Inert atmosphere; Stage #2: oxalic acid diethyl ester In tetrahydrofuran at 20℃; for 2h;	45.6%
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate With lithium hexamethyldisilazane In tetrahydrofuran at -60℃; for 0.5h; Stage #2: oxalic acid diethyl ester at -60 - 20℃; for 1h;

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 2-iodo-1-(2,2,2-trifluoroethyl)-1H-indol-4-amine

: tert-butyl 4-((2-iodo-1-(2,2,2-trifluoroethyl)-1H-indol-4-yl)amino)-3-methylpiperidine-1-carboxylate

Conditions

Conditions	Yield
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate; 2-iodo-1-(2,2,2-trifluoroethyl)-1H-indol-4-amine With chloro-trimethyl-silane In N,N-dimethyl-formamide at 0℃; for 2h; Stage #2: With borane-THF In N,N-dimethyl-formamide at 0 - 25℃; for 1h; Temperature; Reagent/catalyst; Inert atmosphere;	45.28%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 23356-96-9
(S)-1-Pyrrolidin-2-yl-methanol

: tert-butyl 4-((S)-2-(hydroxymethyl)pyrrolidin-1-yl)-3-methylpiperidine-1-carboxylate

Conditions

Conditions	Yield
With sodium tris(acetoxy)borohydride In 1,2-dichloro-ethane at 20℃; for 16h;	40%

: 56278-50-3
2-cyanomethylbenzothiazole

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: tert-butyl 2-amino-3-(benzo[d]thiazol-2-yl)-4-methyl-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate

Conditions

Conditions	Yield
With morpholine; sulfur at 85℃; for 12h;	39%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 4637-24-5
N,N-dimethyl-formamide dimethyl acetal

: 2-methyl-2-thiopseudouronium sulfate

: 1567965-66-5
tert-butyl 8-methyl-2-(methylthio)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxylate

Conditions

Conditions	Yield
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate; N,N-dimethyl-formamide dimethyl acetal at 80℃; for 12h; Stage #2: 2-methyl-2-thiopseudouronium sulfate With sodium ethanolate In ethanol at 80℃; for 12.5h;	36%

...Expand

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 420-04-2
CYANAMID

: 1253415-55-2
C12H19N3O2S

Conditions

Conditions	Yield
With pyridine; sulfur at 100℃; for 3h;	31.3%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: (S)-2-(pyrrolidin-2-yl)ethane-1-sulfonamide

: 2-((S)-1-((3R,4S)-3-methylpiperidin-4-yl)pyrrolidin-2-yl)ethane-1-sulfonamide

Conditions

Conditions	Yield
Stage #1: tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate; (S)-2-(pyrrolidin-2-yl)ethane-1-sulfonamide With sodium tris(acetoxy)borohydride In 1,2-dichloro-ethane at 20℃; for 16h; Stage #2: With trifluoroacetic acid In dichloromethane at 20℃; for 1h;	22%

: 181269-69-2
tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate

: 2627-86-3
(S)-1-phenyl-ethylamine

: 723308-56-3
(3R,4R)-3-methyl-4-(1-(S)-phenyl-ethylamino)-piperidine-1-carboxylic acid tert-butyl ester

Conditions

Conditions	Yield
With sodium triacetoxyborohydride In dichloromethane at 20℃;	10%
With sodium tris(acetoxy)borohydride In dichloromethane at 20℃;	10%

tert-Butyl 3-methyl-4-oxopiperidine-1-carboxylate Specification

The CAS register number of 1-Piperidinecarboxylicacid, 3-methyl-4-oxo-, 1,1-dimethylethyl ester is 179898-50-1. It also can be called as 1-tert-Butoxycarbonyl-3-methyl-4-piperidone and the systematic name about this chemical is tert-butyl 3-methyl-4-oxopiperidine-1-carboxylate. The molecular formula about this chemical is C₁₁H₁₉NO₃ and the molecular weight is 213.27346. It belongs to the following product categorie which include pharmacetical.

Physical properties about 1-Piperidinecarboxylicacid, 3-methyl-4-oxo-, 1,1-dimethylethyl ester are: (1)ACD/LogP: 1.18; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 3; (5)ACD/BCF (pH 7.4): 3; (6)ACD/KOC (pH 5.5): 71; (7)ACD/KOC (pH 7.4): 71; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 46.61 Å²; (11)Index of Refraction: 1.471; (12)Molar Refractivity: 56.278 cm³; (13)Molar Volume: 201.187 cm³; (14)Polarizability: 22.311x10^-24cm³; (15)Surface Tension: 35.848 dyne/cm; (16)Density: 1.06 g/cm³; (17)Flash Point: 134.485 °C; (18)Enthalpy of Vaporization: 53.87 kJ/mol; (19)Boiling Point: 298.758 °C at 760 mmHg; (20)Vapour Pressure: 0.001 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC(=O)N1CCC(=O)C(C)C1
(2)InChI: InChI=1/C11H19NO3/c1-8-7-12(6-5-9(8)13)10(14)15-11(2,3)4/h8H,5-7H2,1-4H3
(3)InChIKey: VWSBNWIPICCWAM-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C11H19NO3/c1-8-7-12(6-5-9(8)13)10(14)15-11(2,3)4/h8H,5-7H2,1-4H3
(5)Std. InChIKey: VWSBNWIPICCWAM-UHFFFAOYSA-N

Product Name

1-BOC-3-METHYL-PIPERIDIN-4-ONE

Synthetic route

tert-Butyl 3-methyl-4-oxopiperidine-1-carboxylate Specification

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