Chem
J-GLOBAL ID：200907077111546781   Nikkaji number：J33.618A

2-Chlorobenzoic acid methyl

2-クロロ安息香酸メチル
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： C8H7ClO2
Molecular formula furigana： C8-H7-CL-O2
Molecular weight： 170.590
InChI： InChI=1S/C8H7ClO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,1H3
InChI key： JAVRNIFMYIJXIE-UHFFFAOYSA-N
SMILES： COC(=O)c1ccccc1Cl
Systematic name  (4)：
  • 2-クロロ安息香酸メチル
  • o-クロロ安息香酸メチル
  • メチル 2-クロロベンゾアート
  • methyl 2-chlorobenzoate
Other name (3)：
  • 2-Chlorobenzoic acid methyl ester
  • o-Chlorobenzoic acid methyl ester
  • 2-Chlorobenzoic acid methyl
CAS registry number： 610-96-8
Regulation number (3)：
  • 4-(7)-1077
  • EINECS2102420
  • TSCA(610-96-8)
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