β-Butyl-2-oxocyclopentanepropanoic acid methyl ester

Modify Date: 2025-08-16 10:26:56

β-Butyl-2-oxocyclopentanepropanoic acid methyl ester Structure
β-Butyl-2-oxocyclopentanepropanoic acid methyl ester structure
Common Name β-Butyl-2-oxocyclopentanepropanoic acid methyl ester
CAS Number 72429-04-0 Molecular Weight 226.31200
Density N/A Boiling Point N/A
Molecular Formula C13H22O3 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name methyl (3S)-3-[(1S)-2-oxocyclopentyl]heptanoate

 Chemical & Physical Properties

Molecular Formula C13H22O3
Molecular Weight 226.31200
Exact Mass 226.15700
PSA 43.37000
LogP 2.72510
InChIKey JZAXFOYWGKXZDF-QWRGUYRKSA-N
SMILES CCCCC(CC(=O)OC)C1CCCC1=O
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