Methyl 7-oxocyclohept-3-ene-1-carboxylate structure

Methyl 7-oxocyclohept-3-ene-1-carboxylate

methyl 7-oxocyclohept-3-ene-1-carboxylate

Also Known As: methyl 7-oxocyclohept-3-ene-1-carboxylate|Methyl 7-oxo-3-cycloheptene-1-carboxylate|J1.895.095B|7-Oxo-3-cycloheptene-1-carboxylic acid methyl ester|7-oxo-cyclohept-3-ene-1-carboxylic acid methyl ester|3-Cycloheptene-1-carboxylic acid, 7-oxo-, methyl ester

CAS: 64670-13-9
Molecular Formula C9H12O3
Molecular Weight 168.07864 g/mol
LogP 1.2
Topological Polar Surface Area 43.4 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 2
Exact Mass 168.07864
Monoisotopic Mass 168.07864
Heavy Atoms 12
Complexity 218.0

Chemical Identifiers

CAS Number 64670-13-9
SMILES COC(=O)C1CC=CCCC1=O
InChIKey SEPYLLHVJDBTNY-UHFFFAOYSA-N

Product Overview

Methyl 7-oxocyclohept-3-ene-1-carboxylate (CAS 64670-13-9), with molecular formula C9H12O3 and molecular weight 168.07864 g/mol. IUPAC: methyl 7-oxocyclohept-3-ene-1-carboxylate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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