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Substance Name: Benzeneacetic acid, 5-(4-fluorobenzoyl)-2-hydroxy-alpha-methyl-
RN: 109217-31-4
InChIKey: OGAVHGJFZVDKLN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H13-F-O4

Molecular Weight

  • 288.2727
 
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Names and Synonyms

Synonyms

  • 5-(4-Fluorobenzoyl)-2-hydroxy-alpha-methylbenzeneacetic acid
  • BRN 6733120

Systematic Name

  • Benzeneacetic acid, 5-(4-fluorobenzoyl)-2-hydroxy-alpha-methyl-

Registry Numbers

CAS Registry Number

  • 109217-31-4

System Generated Number

  • 0109217314

Structure Descriptors

InChI

1S/C16H13FO4/c1-9(16(20)21)13-8-11(4-7-14(13)18)15(19)10-2-5-12(17)6-3-10/h2-9,18H,1H3,(H,20,21)

InChIKey

OGAVHGJFZVDKLN-UHFFFAOYSA-N

Smiles

CC(c1cc(ccc1O)C(=O)c2ccc(cc2)F)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 800mg/kg (800mg/kg)   Journal of Medicinal Chemistry. Vol. 30, Pg. 1663, 1987.