Chem
J-GLOBAL ID：200907033980435313   Nikkaji number：J7.798D

4-Chlorobenzeneacetic acid

4-クロロベンゼン酢酸
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： C8H7ClO2
Molecular formula furigana： C8-H7-CL-O2
Molecular weight： 170.590
InChI： InChI=1S/C8H7ClO2/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H,10,11)
InChI key： CDPKJZJVTHSESZ-UHFFFAOYSA-N
SMILES： OC(=O)Cc1ccc(Cl)cc1
Systematic name  (6)：
  • 2-(4-クロロフェニル)酢酸
  • 4-クロロフェニル酢酸
  • 4-クロロベンゼン酢酸
  • (4-クロロフェニル)酢酸
  • p-クロロフェニル酢酸
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Other name (9)：
  • PCPA
  • 4-Chlorobenzeneacetic acid
  • (4-Chlorophenyl)acetic acid
  • p-Chlorophenylacetic acid
  • 2-(4′-クロロフェニル)酢酸
Show all
CAS registry number： 1878-66-6
Regulation number (4)：
  • (3)-3081
  • AG0590000
  • EINECS2175216
  • TSCA(1878-66-6)
KEGG COMPOUND： C03077
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