Molecule record

3-acetamidobenzoic acid

C9H9NO3

179.17 g/mol

Loading structure

Molecular properties

Formula
C9H9NO3
Molar mass
179.17 g·mol−1
Exact mass
179.0582 Da
6
PubChem CID
48847

Functional groups

Alkane / alkyl carbon
Amide
Aromatic ring
Carboxylic acid
Secondary amine

Physical properties

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

Common names and synonyms

  • 209-600-9
  • 3-(Acetylamino)benzoic acid
  • 3-ACETAMIDOBENZOICACID
  • 3-Acetylamino-benzoic acid
  • 3-acetamidobenzoate sodium salt
  • 587-48-4
  • A1JL1
  • Acetyl-m-aminobenzoic acid
Show all 24 synonyms
  • Benzoic acid, 3-(acetylamino)-
  • Benzoic acid, m-acetamido-
  • Cambridge id 5128194
  • DTXCID4042460
  • DTXSID2060418
  • EINECS 209-600-9
  • MFCD00013983
  • N-acetyl-m-aminobenzoic acid
  • NSC 4001
  • Oprea1_345814
  • Oprea1_558864
  • RefChem:92768
  • m-Acetamidobenzoic acid
  • m-Acetamino benzoic acid
  • m-Acetylaminobenzoesaure
  • m-Acetylaminobenzoic acid

Structure identifiers

Canonical SMILES
CC(=O)Nc1cccc(C(=O)O)c1
Isomeric SMILES
CC(=O)NC1=CC=CC(=C1)C(=O)O
InChI
InChI=1S/C9H9NO3/c1-6(11)10-8-4-2-3-7(5-8)9(12)13/h2-5H,1H3,(H,10,11)(H,12,13)
InChIKey
RGDPZMQZWZMONQ-UHFFFAOYSA-N
PubChem CID
48847

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-acetamidobenzoic acid; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 3-acetamidobenzoic acid; 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