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Substance Name: Benzonitrile, 2,3-dihydroxy-5-(2-fluorobenzoyl)-
RN: 125629-17-6
InChIKey: ZSTLBCUHYUTGRS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H8-F-N-O3

Molecular Weight

  • 257.2192
 
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Names and Synonyms

Synonym

  • 2,3-Dihydroxy-5-(2-fluorobenzoyl)benzonitrile

Systematic Name

  • Benzonitrile, 2,3-dihydroxy-5-(2-fluorobenzoyl)-

Registry Numbers

CAS Registry Number

  • 125629-17-6

System Generated Number

  • 0125629176

Structure Descriptors

InChI

1S/C14H8FNO3/c15-11-4-2-1-3-10(11)13(18)8-5-9(7-16)14(19)12(17)6-8/h1-6,17,19H

InChIKey

ZSTLBCUHYUTGRS-UHFFFAOYSA-N

Smiles

c1ccc(c(c1)C(=O)c2cc(c(c(c2)O)O)C#N)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 500mg/kg (500mg/kg)   Helvetica Chimica Acta. Vol. 72, Pg. 952, 1989.