Chem
J-GLOBAL ID：200907027305966334   Nikkaji number：J94.962K

3-Bromobenzoic acid

3-ブロモ安息香酸
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C7H5BrO2
Molecular formula furigana： C7-H5-BR-O2
Molecular weight： 201.019
InChI： InChI=1S/C7H5BrO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,(H,9,10)
InChI key： VOIZNVUXCQLQHS-UHFFFAOYSA-N
SMILES： OC(=O)c1cccc(Br)c1
Systematic name  (3)：
  • 3-ブロモ安息香酸
  • m-ブロモ安息香酸
  • 3-bromobenzoic acid
Other name (2)：
  • m-Bromobenzoic acid
  • 3-Bromobenzoic acid
CAS registry number： 585-76-2
Regulation number (3)：
  • (3)-62
  • EINECS2095623
  • TSCA(585-76-2)
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