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Substance Name: 3,3-Triazenediethanol, 1-(5-nitro-4-imidazolyl)-
RN: 82039-96-1
InChIKey: DVYRQZVNBYRGMN-ZHACJKMWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H12-N6-O4

Molecular Weight

  • 244.2098
 
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Names and Synonyms

Synonyms

  • 1-(5-Nitro-4-imidazolyl)-3,3-triazenediethanol
  • Ethanol, 2,2'-(3-(5-nitro-1H-imidazol-4-yl)-2-triazenylidene)bis-

Systematic Name

  • 3,3-Triazenediethanol, 1-(5-nitro-4-imidazolyl)-

Registry Numbers

CAS Registry Number

  • 82039-96-1

System Generated Number

  • 0082039961

Structure Descriptors

InChI

1S/C7H12N6O4/c14-3-1-12(2-4-15)11-10-6-7(13(16)17)9-5-8-6/h5,14-15H,1-4H2,(H,8,9)/b11-10+

InChIKey

DVYRQZVNBYRGMN-ZHACJKMWSA-N

Smiles

c1[nH]c(c(n1)/N=N/N(CCO)CCO)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 50ug/kg (0.05mg/kg)   Pharmaceutical Chemistry Journal Vol. 16, Pg. 203, 1982.