[(2R,3R,4S)-3-methyl-2-[(1E,3E)-4-phenylbuta-1,3-dienyl]piperidin-1-ium-4-yl] 2-methylpropanoate,chloride

Modify Date: 2025-11-25 18:18:47

[(2R,3R,4S)-3-methyl-2-[(1E,3E)-4-phenylbuta-1,3-dienyl]piperidin-1-ium-4-yl] 2-methylpropanoate,chloride Structure
[(2R,3R,4S)-3-methyl-2-[(1E,3E)-4-phenylbuta-1,3-dienyl]piperidin-1-ium-4-yl] 2-methylpropanoate,chloride structure
Common Name [(2R,3R,4S)-3-methyl-2-[(1E,3E)-4-phenylbuta-1,3-dienyl]piperidin-1-ium-4-yl] 2-methylpropanoate,chloride
CAS Number 26834-29-7 Molecular Weight 349.89500
Density N/A Boiling Point N/A
Molecular Formula C20H28ClNO2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name [(2R,3R,4S)-3-methyl-2-[(1E,3E)-4-phenylbuta-1,3-dienyl]piperidin-1-ium-4-yl] 2-methylpropanoate,chloride
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C20H28ClNO2
Molecular Weight 349.89500
Exact Mass 349.18100
PSA 38.33000
LogP 4.95260
Vapour Pressure 1.46E-07mmHg at 25°C
InChIKey CCVMKXIKKJBYRX-AKOPKFBKSA-N
SMILES CC(C)C(=O)OC1CC[NH2+]C(C=CC=Cc2ccccc2)C1C.[Cl-]

 Synonyms

4-Isobutyryloxy-3-methyl-2-(4-phenylbutadienyl)piperidine hydrochloride
Dienomycin A hydrochloride
Isobutyric acid,3-methyl-2-(4-phenyl-1,3-butadienyl)-4-piperidyl ester,hydrochloride,(E,E)-trans-2,3-trans-2,4
[(2R,3R,4S)-3-methyl-2-[(1E,3E)-4-phenylbuta-1,3-dienyl]piperidin-1-ium-4-yl] 2-methylpropanoate chloride
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