2-Oxocyclohexyl benzoate structure

2-Oxocyclohexyl benzoate

(2-oxocyclohexyl) benzoate

Also Known As: 2-Oxocyclohexyl benzoate|(2-oxocyclohexyl) benzoate|(2-oxocyclohexyl)benzoate|2-(Benzoyloxy)cyclohexanone|Benzoic acid 2-oxocyclohexyl ester|J2.259.679I

CAS: 7472-23-3
Molecular Formula C13H14O3
Molecular Weight 218.0943 g/mol
LogP 2.4
Topological Polar Surface Area 43.4 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 3
Exact Mass 218.0943
Monoisotopic Mass 218.0943
Heavy Atoms 16
Complexity 266.0

Chemical Identifiers

CAS Number 7472-23-3
SMILES C1CCC(=O)C(C1)OC(=O)C2=CC=CC=C2
InChIKey LEVSNIXDZWEGEC-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (38 patents) Heterocyclic Building Blocks (136 patents) Organic Building Blocks (7 patents) Organometallic Reagents (2 patents) Pharmaceutical Intermediates (31 patents)

Product Overview

2-Oxocyclohexyl benzoate (CAS 7472-23-3), with molecular formula C13H14O3 and molecular weight 218.0943 g/mol. IUPAC: (2-oxocyclohexyl) benzoate.

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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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