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Molecule record

(3-formylphenyl) acetate

C9H8O3

164.16 g/mol

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Molecular properties

Formula
C9H8O3
Molar mass
164.16 g·mol−1
Exact mass
164.0473 Da
6
PubChem CID
118618

Functional groups

Aldehyde
Alkane / alkyl carbon
Aromatic ring
Ester
Ether

Physical properties

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

Common names and synonyms

  • 251-890-4
  • 3-Acetoxybenzaldehyde
  • 3-Formylphenylacetate
  • 34231-78-2
  • AI3-31881
  • AKOS006230162
  • Acetic Acid 3-Formylphenyl Ester
  • Benzaldehyde, 3-(acetyloxy)-
Show all 24 synonyms
  • CS-W014313
  • DTXCID00110299
  • DTXSID80187808
  • EINECS 251-890-4
  • FA70376
  • InChI=1/C9H8O3/c1-7(11)12-9-4-2-3-8(5-9)6-10/h2-6H,1H
  • MFCD00016603
  • RefChem:502082
  • SBB064213
  • SCHEMBL2094506
  • SCHEMBL29456918
  • SCHEMBL6555328
  • SCHEMBL7679108
  • m-Hydroxybenzaldehyde acetate
  • m-ace-toxybenzaldehyde
  • m-acetoxybenzaldehyde

Structure identifiers

Canonical SMILES
CC(=O)Oc1cccc(C=O)c1
Isomeric SMILES
CC(=O)OC1=CC=CC(=C1)C=O
InChI
InChI=1S/C9H8O3/c1-7(11)12-9-4-2-3-8(5-9)6-10/h2-6H,1H3
InChIKey
GVUMZPWBUAGJBP-UHFFFAOYSA-N
PubChem CID
118618

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 (3-formylphenyl) acetate; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for (3-formylphenyl) acetate; not experimental data.

Sources

Molecule identity

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

PubChem(link only)
Open source record