Molecule record

3H-1,3-benzoxazol-2-one

C7H5NO2

135.12 g/mol

Loading structure

Molecular properties

Formula
C7H5NO2
Molar mass
135.12 g·mol−1
Exact mass
135.0320 Da
6
PubChem CID
6043

Functional groups

Aromatic ring

Physical properties

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

Common names and synonyms

  • 1,3-Benzoxazol-2(3H)-one
  • 1,3-benzoxazol-2-ol
  • 2(3H)-Benzoxazolone
  • 2-BENZOXAZOLINONE
  • 2-Benzoxazolol
  • 2-Benzoxazolone
  • 2-Hydroxybenzoxazole
  • 200-430-0
Show all 24 synonyms
  • 3H-benzooxazol-2-one
  • 3X996Q809V
  • 59-49-4
  • Benzo[D]Oxazol-2(3H)-One
  • Benzoxazole, 2-hydroxy-
  • Benzoxazolinone
  • Benzoxazolone
  • CHEBI:145233
  • DTXCID8029280
  • DTXSID9049324
  • NSC-3812
  • RefChem:85562
  • benzoxalinone
  • benzoxazolin-2(3H)-one
  • benzoxazolin-2-one
  • benzoxazolone-2

Structure identifiers

Canonical SMILES
O=c1[nH]c2ccccc2o1
Isomeric SMILES
C1=CC=C2C(=C1)NC(=O)O2
InChI
InChI=1S/C7H5NO2/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)
InChIKey
ASSKVPFEZFQQNQ-UHFFFAOYSA-N
PubChem CID
6043

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 3H-1,3-benzoxazol-2-one; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 3H-1,3-benzoxazol-2-one; 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