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Substance Name: Benzonitrile, 3,4-dihydroxy-5-nitro-
RN: 116313-86-1
InChIKey: JRBDMOJXCREXNN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H4-N2-O4

Molecular Weight

  • 180.1186
 
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Names and Synonyms

Synonyms

  • 3,4-Dihydroxy-5-nitrobenzonitrile
  • BRN 6480172

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 116313-86-1

System Generated Number

  • 0116313861

Structure Descriptors

InChI

1S/C7H4N2O4/c8-3-4-1-5(9(12)13)7(11)6(10)2-4/h1-2,10-11H

InChIKey

JRBDMOJXCREXNN-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 312mg/kg (312mg/kg)   Helvetica Chimica Acta. Vol. 72, Pg. 952, 1989.