Chem
J-GLOBAL ID：200907011059529937   Nikkaji number：J96.121C

Methyl 3-bromobenzoate

3-ブロモ安息香酸メチル
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： C8H7BrO2
Molecular formula furigana： C8-H7-BR-O2
Molecular weight： 215.046
InChI： InChI=1S/C8H7BrO2/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5H,1H3
InChI key： KMFJVYMFCAIRAN-UHFFFAOYSA-N
SMILES： COC(=O)c1cccc(Br)c1
Systematic name  (5)：
  • 3-ブロモ安息香酸メチル
  • メチルm-ブロモベンゾアート
  • m-ブロモ安息香酸メチル
  • メチル 3-ブロモベンゾアート
  • methyl 3-bromobenzoate
Other name (3)：
  • Methyl m-bromobenzoate
  • m-Bromobenzoic acid methyl ester
  • Methyl 3-bromobenzoate
CAS registry number： 618-89-3
Regulation number (2)：
  • EINECS2105699
  • TSCA(618-89-3)
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