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Substance Name: Benzenebutanoic acid, 3,4-dichloro-alpha-hydroxy-gamma-oxo-
RN: 81008-09-5
InChIKey: OFKDXERWJCPSAE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H8-Cl2-O4

Molecular Weight

  • 263.0752
 
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Names and Synonyms

Synonyms

  • 3,4-Dichloro-alpha-hydroxy-gamma-oxobenzenebutanoic acid
  • 4-(3,4-Dichlorophenyl)-4-oxo-2-hydroxybutanoic acid

Systematic Name

  • Benzenebutanoic acid, 3,4-dichloro-alpha-hydroxy-gamma-oxo-

Registry Numbers

CAS Registry Number

  • 81008-09-5

System Generated Number

  • 0081008095

Structure Descriptors

InChI

1S/C10H8Cl2O4/c11-6-2-1-5(3-7(6)12)8(13)4-9(14)10(15)16/h1-3,9,14H,4H2,(H,15,16)

InChIKey

OFKDXERWJCPSAE-UHFFFAOYSA-N

Smiles

c1cc(c(cc1C(=O)CC(C(=O)O)O)Cl)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   British UK Patent Application. Vol. #2074575,