Molecular properties
- Formula
- C9H8O4
- Molar mass
- 180.16 g·mol−1
- Exact mass
- 180.0422 Da
- 6
- PubChem CID
- 238669
Molecule record
3-acetyloxybenzoic acid
C9H8O4
180.16 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Carboxylic acid
Ester
Ether
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 3-ACETOXYBENZOICACID
- 3-Acetoxybenzoesaure
- 3-Acetoxybenzoic acid
- 3-Acetoxybenzoic acid 98%
- 3-acetoxy benzoic acid
- 3-acetyloxybenzoicaci
- 628-787-1
- 6304-89-8
Show all 24 synonyms
- AKOS005068238
- Benzoic acid, 3-(acetyloxy)-
- Benzoic acid, m-acetoxy
- DTXCID90237040
- DTXSID90285889
- MFCD00016699
- NSC 43147
- NSC43147
- RARECHEM AL BE 0249
- RefChem:496556
- SCHEMBL21268244
- SCHEMBL258461
- SCHEMBL28466125
- SCHEMBL29492631
- m-Acetoxy Benzoic Acid
- m-acetoxybenzoicacid
Structure identifiers
- Canonical SMILES
- CC(=O)Oc1cccc(C(=O)O)c1
- Isomeric SMILES
- CC(=O)OC1=CC=CC(=C1)C(=O)O
- InChI
- InChI=1S/C9H8O4/c1-6(10)13-8-4-2-3-7(5-8)9(11)12/h2-5H,1H3,(H,11,12)
- InChIKey
- NGMYCWFGNSXLMP-UHFFFAOYSA-N
- PubChem CID
- 238669
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 3-acetyloxybenzoic acid; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 3-acetyloxybenzoic acid; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.