2-Oxepanone, 4-methyl- structure

2-Oxepanone, 4-methyl-

4-methyloxepan-2-one

Also Known As: 4-methyloxepan-2-one|2-Oxepanone, 4-methyl-|4-Methyl-2-oxepanone|4-Methyl-2-oxepanone #|4-Methylhexahydrooxepin-2-one|beta-Methyl-epsilon-caprolacton|4-Methyl-4,5,6,7-tetrahydrooxepin-2(3H)-one

CAS: 2549-60-2
Molecular Formula C7H12O2
Molecular Weight 128.08372 g/mol
LogP 1.3
Topological Polar Surface Area 26.3 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 0
Exact Mass 128.08372
Monoisotopic Mass 128.08372
Heavy Atoms 9
Complexity 109.0

Chemical Identifiers

CAS Number 2549-60-2
SMILES CC1CCCOC(=O)C1
InChIKey CHXLFXLPKLZALY-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (2 patents) Coatings & Adhesives (47 patents) Heterocyclic Building Blocks (16 patents) Organic Building Blocks (24 patents) Organometallic Reagents (8 patents) Paper Chemicals (2 patents) Plastic Additives (6 patents) Polymer Intermediates (152 patents) Specialty Chemicals (8 patents)

Product Overview

2-Oxepanone, 4-methyl- (CAS 2549-60-2), with molecular formula C7H12O2 and molecular weight 128.08372 g/mol. IUPAC: 4-methyloxepan-2-one.

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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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