Molecule record

benzyl acetate

C9H10O2

150.18 g/mol

Loading structure

Molecular properties

Formula
C9H10O2
Molar mass
150.18 g·mol−1
Exact mass
150.0681 Da
5
PubChem CID
8785

Functional groups

Alkane / alkyl carbon
Aromatic ring
Ester
Ether

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • (Acetoxymethyl)benzene
  • .alpha.-Acetoxytoluene
  • 0ECG3V79ZJ
  • 140-11-4
  • 205-399-7
  • Acetic acid benzyl ester
  • Acetic acid, phenylmethyl ester
  • Benzyl ester of acetic acid
Show all 24 synonyms
  • Benzyl ethanoate
  • Benzyl-23456-d5 Acetate
  • Benzylester kyseliny octove
  • CHEBI:52051
  • Caswell No. 081EA
  • DTXCID40151
  • DTXSID0020151
  • FEMA No. 2135
  • MFCD00008712
  • NCI-C06508
  • NSC-4550
  • Phenylmethyl acetate
  • Phenylmethyl ethanoate
  • Plastolin I
  • RefChem:5593
  • alpha-Acetoxytoluene

Structure identifiers

Canonical SMILES
CC(=O)OCc1ccccc1
Isomeric SMILES
CC(=O)OCC1=CC=CC=C1
InChI
InChI=1S/C9H10O2/c1-8(10)11-7-9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChIKey
QUKGYYKBILRGFE-UHFFFAOYSA-N
PubChem CID
8785

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for benzyl acetate; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for benzyl acetate; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record