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Substance Name: Benzonitrile, 2-chloro-3,4-dihydroxy-5-nitro-
RN: 125629-22-3
InChIKey: FCCMPPPCJVQGBC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H3-Cl-N2-O4

Molecular Weight

  • 214.5637
 
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Names and Synonyms

Synonym

  • 2-Chloro-3,4-dihydroxy-5-nitrobenzonitrile

Systematic Name

  • Benzonitrile, 2-chloro-3,4-dihydroxy-5-nitro-

Registry Numbers

CAS Registry Number

  • 125629-22-3

System Generated Number

  • 0125629223

Structure Descriptors

InChI

1S/C7H3ClN2O4/c8-5-3(2-9)1-4(10(13)14)6(11)7(5)12/h1,11-12H

InChIKey

FCCMPPPCJVQGBC-UHFFFAOYSA-N

Smiles

c1c(c(c(c(c1[N+](=O)[O-])O)O)Cl)C#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 625mg/kg (625mg/kg)   Helvetica Chimica Acta. Vol. 72, Pg. 952, 1989.