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Molecule record

3-bromo-1,2-oxazole

C3H2BrNO

147.96 g/mol

Loading structure

Molecular properties

Formula
C3H2BrNO
Molar mass
147.96 g·mol−1
Exact mass
146.9320 Da
3
PubChem CID
13933891

Functional groups

Aryl halide

Physical properties

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

Common names and synonyms

  • 111454-71-8
  • 3-BROMOISOXAZOLE
  • 3-Bromo-isoxazole
  • 3-Bromo-isoxazole, AldrichCPR
  • 3-bromanyl-1,2-oxazole
  • 808-475-3
  • AKOS006286136
  • AM802930
Show all 24 synonyms
  • BCP21100
  • CS-0039114
  • DTXCID30503635
  • DTXSID00552852
  • GQMPHUXGZCDVGQ-UHFFFAOYSA-N
  • Isoxazole, 3-bromo-
  • MFCD07778379
  • RefChem:498135
  • SB30685
  • SCHEMBL193109
  • SCHEMBL487524
  • SCHEMBL742724
  • SY009266
  • bromo-isoxazole
  • bromoisoxazole
  • racemic bromoisoxazole

Structure identifiers

Canonical SMILES
Brc1ccon1
Isomeric SMILES
C1=CON=C1Br
InChI
InChI=1S/C3H2BrNO/c4-3-1-2-6-5-3/h1-2H
InChIKey
GQMPHUXGZCDVGQ-UHFFFAOYSA-N
PubChem CID
13933891

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-bromo-1,2-oxazole; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 3-bromo-1,2-oxazole; 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
3-bromo-1,2-oxazole - Formula, Structure | ChemArche