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Substance Name: 1H-Benzimidazol-5-amine, 4,6-dinitro-N-phenyl-
RN: 52301-16-3
InChIKey: MXQSPQMJXLYOHZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H9-N5-O4

Molecular Weight

  • 299.245
 
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Names and Synonyms

Synonyms

  • 4,6-Dinitro-N-phenyl-1H-benzimidazol-5-amine
  • BRN 0935285

Systematic Name

  • 1H-Benzimidazol-5-amine, 4,6-dinitro-N-phenyl-

Registry Numbers

CAS Registry Number

  • 52301-16-3

System Generated Number

  • 0052301163

Structure Descriptors

InChI

1S/C13H9N5O4/c19-17(20)10-6-9-11(15-7-14-9)13(18(21)22)12(10)16-8-4-2-1-3-5-8/h1-7,16H,(H,14,15)

InChIKey

MXQSPQMJXLYOHZ-UHFFFAOYSA-N

Smiles

c1(c(c([N+]([O-])=O)cc2c1nc[nH]2)Nc1ccccc1)[N+]([O-])=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 17, Pg. 164, 1979.