Molecule record

2-bromo-1-phenylethanone

C8H7BrO

199.05 g/mol

Loading structure

Molecular properties

Formula
C8H7BrO
Molar mass
199.05 g·mol−1
Exact mass
197.9680 Da
5
PubChem CID
6259

Functional groups

Alkane / alkyl carbon
Alkyl halide
Aromatic ring
Ketone

Physical properties

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

Common names and synonyms

  • 2-BROMACETOPHENONE
  • 2-Bromo-1-Phenylethan-1-One
  • 2-Bromoacetophenone
  • 70-11-1
  • 754Y0U325I
  • ALPHA-BROMOACETOPHENONE
  • Acetophenone, 2-bromo-
  • Benzoylmethyl bromide
Show all 24 synonyms
  • Bromoacetophenone
  • Bromomethyl phenyl ketone
  • CHEBI:51846
  • DTXCID1029386
  • DTXSID2049426
  • Ethanone, 2-bromo-1-phenyl-
  • NSC-9807
  • Phenacyl bromide
  • RefChem:860515
  • Stauffer 4644
  • UN-2645
  • UN2645
  • omega-Bromacetophenone
  • omega-Bromoacetophenone
  • phenacylbromide
  • phenyl bromomethyl ketone

Structure identifiers

Canonical SMILES
O=C(CBr)c1ccccc1
Isomeric SMILES
C1=CC=C(C=C1)C(=O)CBr
InChI
InChI=1S/C8H7BrO/c9-6-8(10)7-4-2-1-3-5-7/h1-5H,6H2
InChIKey
LIGACIXOYTUXAW-UHFFFAOYSA-N
PubChem CID
6259

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 2-bromo-1-phenylethanone; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 2-bromo-1-phenylethanone; not experimental data.

Sources

Molecule identity

Retrieved 8/19/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record