| Identification | Back Directory | [Name]
1-Benzyl-4-methyl-piperidin-3-one hydrochloride | [CAS]
1303968-15-1 | [Synonyms]
piperidin-3-one hydrochL
1-Benzyl-4-methyl-3-piperidinone Hydrochloride
1-Benzyl-4-methyl-piperidin-3-one hydrochloride
1-benzyl-4-methyl piperidine-3-one hydrochloride
3-?Piperidinone, 4-?methyl-?1-?(phenylmethyl)?-?, hydrochloride (1:1) | [Molecular Formula]
C13H18ClNO | [MDL Number]
MFCD18914352 | [MOL File]
1303968-15-1.mol | [Molecular Weight]
239.75 |
| Chemical Properties | Back Directory | [storage temp. ]
Inert atmosphere,2-8°C | [InChI]
InChI=1S/C13H17NO.ClH/c1-11-7-8-14(10-13(11)15)9-12-5-3-2-4-6-12;/h2-6,11H,7-10H2,1H3;1H | [InChIKey]
PZBKCGGUKLHTJJ-UHFFFAOYSA-N | [SMILES]
C(C1C=CC=CC=1)N1CCC(C)C(=O)C1.Cl |
| Hazard Information | Back Directory | [Uses]
1-Benzyl-4-methyl-piperidin-3-one hydrochloride was used for the preparation of key intermediates of tofacitinib. Protein IR89 was utilized to catalyze the generation of (3R, 4R)-1-benzyl-N, 4-dimethylpiperidin-3-amine dihydrochloride from 1-benzyl-4-methylpiperidin-3-one or its hydrochloride and methylamine or its hydrochloride. |
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