ChemArche
Sign inAccount

Molecule record

3-bromo-1-benzothiophene

C8H5BrS

213.10 g/mol

Loading structure

Molecular properties

Formula
C8H5BrS
Molar mass
213.10 g·mol−1
Exact mass
211.9295 Da
6
PubChem CID
123250

Functional groups

Aromatic ring
Aryl halide

Physical properties

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

Common names and synonyms

  • 3-Bromo-1-benzothiophene #
  • 3-Bromo-benzo[b]thiophene
  • 3-Bromobenzo[b]thiophene
  • 3-Bromobenzothiophene
  • 3-Bromothianaphthene
  • 3-Bromothianaphthene, 95%
  • 3-bromo benzothiophene
  • 680-931-2
Show all 24 synonyms
  • 7342-82-7
  • A837829
  • AM87162
  • B5589
  • BIDD:GT0742
  • Benzo[b]thiophene, 3-bromo-
  • DTXCID10146145
  • DTXSID80223654
  • FT-0615123
  • MFCD00023009
  • RefChem:565171
  • SCHEMBL2093258
  • SCHEMBL264791
  • SCHEMBL317826
  • SCHEMBL3816084
  • SCHEMBL8780181

Structure identifiers

Canonical SMILES
Brc1csc2ccccc12
Isomeric SMILES
C1=CC=C2C(=C1)C(=CS2)Br
InChI
InChI=1S/C8H5BrS/c9-7-5-10-8-4-2-1-3-6(7)8/h1-5H
InChIKey
SRWDQSRTOOMPMO-UHFFFAOYSA-N
PubChem CID
123250

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-benzothiophene; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 3-bromo-1-benzothiophene; 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