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Substance Name: Benzeneacetic acid, 4-benzoyl-alpha-methyl-
RN: 22410-97-5
InChIKey: RIOUIOIZYLTJEZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H14-O3

Molecular Weight

  • 254.284
 
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Names and Synonyms

Synonyms

  • 4-Benzoyl-alpha-methylbenzeneacetic acid
  • BRN 2735553
  • p-Benzoylhydratropic acid

Systematic Names

  • Benzeneacetic acid, 4-benzoyl-alpha-methyl-
  • Hydratropic acid, p-benzoyl- (8CI)

Registry Numbers

CAS Registry Number

  • 22410-97-5

System Generated Number

  • 0022410975

Structure Descriptors

InChI

1S/C16H14O3/c1-11(16(18)19)12-7-9-14(10-8-12)15(17)13-5-3-2-4-6-13/h2-11H,1H3,(H,18,19)

InChIKey

RIOUIOIZYLTJEZ-UHFFFAOYSA-N

Smiles

c1(ccc(cc1)C(c1ccccc1)=O)[C@@H](C(=O)O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 1gm/kg (1000mg/kg)   Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 77, Pg. 321, 1981.