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(2S)-tert-Butyl 3-cyano-2-methyl-4-oxopiperidine-1-carboxylate

CAS No.
2212021-56-0
Chemical Name:
(2S)-tert-Butyl 3-cyano-2-methyl-4-oxopiperidine-1-carboxylate
Synonyms
(2S)-tert-Butyl 3-cyano-2-methyl-4-oxopiperidine-1-carboxylate;tert-butyl (2S)-3-cyano-2-methyl-4-oxo-piperidine-1-carboxylate;1-Piperidinecarboxylic acid, 3-cyano-2-methyl-4-oxo-, 1,1-dimethylethyl ester, (2S)-
CBNumber:
CB76193288
Molecular Formula:
C12H18N2O3
Molecular Weight:
238.28
MDL Number:
MFCD32856687
MOL File:
2212021-56-0.mol
Last updated:2024-01-08 11:28:09

(2S)-tert-Butyl 3-cyano-2-methyl-4-oxopiperidine-1-carboxylate Properties

Boiling point 379.3±42.0 °C(Predicted)
Density 1.13±0.1 g/cm3(Predicted)
pka -3.66±0.60(Predicted)
InChI InChI=1S/C12H18N2O3/c1-8-9(7-13)10(15)5-6-14(8)11(16)17-12(2,3)4/h8-9H,5-6H2,1-4H3/t8-,9?/m0/s1
InChIKey HWSFSGRTZMJYGQ-IENPIDJESA-N
SMILES N1(C(OC(C)(C)C)=O)CCC(=O)C(C#N)[C@@H]1C

(2S)-tert-Butyl 3-cyano-2-methyl-4-oxopiperidine-1-carboxylate Preparation Products And Raw materials

Raw materials

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(2S)-tert-Butyl 3-cyano-2-methyl-4-oxopiperidine-1-carboxylate 1-Piperidinecarboxylic acid, 3-cyano-2-methyl-4-oxo-, 1,1-dimethylethyl ester, (2S)- tert-butyl (2S)-3-cyano-2-methyl-4-oxo-piperidine-1-carboxylate 2212021-56-0 1