Chem
J-GLOBAL ID：200907026264407957   Nikkaji number：J225.349F

4-(2-Chloroethyl)benzoic acid

4-(2-クロロエチル)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： C9H9ClO2
Molecular formula furigana： C9-H9-CL-O2
Molecular weight： 184.620
InChI： InChI=1S/C9H9ClO2/c10-6-5-7-1-3-8(4-2-7)9(11)12/h1-4H,5-6H2,(H,11,12)
InChI key： OOAPBGPLZAFZSO-UHFFFAOYSA-N
SMILES： OC(=O)c1ccc(CCCl)cc1
Systematic name  (2)：
  • 4-(2-クロロエチル)安息香酸
  • 4-(2-chloroethyl)benzoic acid
Other name (1)：
  • 4-(2-Chloroethyl)benzoic acid
CAS registry number： 20849-78-9
Regulation number (1)：
  • EINECS2440807
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