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Molecule record

1,2-oxazol-4-ol

C3H3NO2

85.06 g/mol

Loading structure

Molecular properties

Formula
C3H3NO2
Molar mass
85.06 g·mol−1
Exact mass
85.0164 Da
3
PubChem CID
13117012

Functional groups

Phenol

Physical properties

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

Common names and synonyms

  • 4-Isoxazolol
  • 4-hydroxyisoxazole
  • 80348-66-9
  • 856-410-2
  • ABFBKQBATYREHU-UHFFFAOYSA-N
  • AKOS026730116
  • AT21052
  • CS-0224031
Show all 19 synonyms
  • DB-003491
  • DTXSID30902402
  • EN300-117533
  • F546839
  • MFCD18909313
  • RefChem:412110
  • SCHEMBL126933
  • SCHEMBL277061
  • SCHEMBL277062
  • SY147548
  • isoxazol-4-ol

Structure identifiers

Canonical SMILES
Oc1cnoc1
Isomeric SMILES
C1=C(C=NO1)O
InChI
InChI=1S/C3H3NO2/c5-3-1-4-6-2-3/h1-2,5H
InChIKey
ABFBKQBATYREHU-UHFFFAOYSA-N
PubChem CID
13117012

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 1,2-oxazol-4-ol; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1,2-oxazol-4-ol; 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