Molecule record

3-bromothiophene

C4H3BrS

163.04 g/mol

Loading structure

Molecular properties

Formula
C4H3BrS
Molar mass
163.04 g·mol−1
Exact mass
161.9139 Da
3
PubChem CID
13383

Functional groups

Aryl halide

Physical properties

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

Common names and synonyms

  • .beta.-Bromothiophene
  • 212-821-3
  • 3-Bromothiofuran
  • 3-Bromothiophene, 97%
  • 3-Thienyl bromide
  • 3-bromo-thiophene
  • 3-bromothiphene
  • 3-bromthiophene
Show all 24 synonyms
  • 84928-93-8
  • 872-31-1
  • DTXCID602129
  • DTXSID2022129
  • EINECS 212-821-3
  • G818Z74YV0
  • InChI=1/C4H3BrS/c5-4-1-2-6-3-4/h1-3
  • MFCD00005464
  • NSC 96612
  • NSC96612
  • RefChem:93270
  • SCHEMBL3339
  • Thiophene, 3-bromo-
  • UNII-G818Z74YV0
  • XCMISAPCWHTVNG-UHFFFAOYSA-N
  • beta-Bromothiophene

Structure identifiers

Canonical SMILES
Brc1ccsc1
Isomeric SMILES
C1=CSC=C1Br
InChI
InChI=1S/C4H3BrS/c5-4-1-2-6-3-4/h1-3H
InChIKey
XCMISAPCWHTVNG-UHFFFAOYSA-N
PubChem CID
13383

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-bromothiophene; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 3-bromothiophene; 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