Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1H-Benzimidazole-5-carbonitrile, 2-amino-
RN: 63655-40-3
InChIKey: PNMKRBOIMTZVLQ-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C8-H6-N4

Molecular Weight

  • 158.163
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 2-Amino-1H-benzimidazole-5-carbonitrile
  • 5-Cyano-2-aminobenzimidazole
  • BRN 0880339
  • CCRIS 4358

Systematic Names

  • 1H-Benzimidazole-5-carbonitrile, 2-amino-
  • 5-Cyano-2-aminobenzimidazole

Registry Numbers

CAS Registry Number

  • 63655-40-3

System Generated Number

  • 0063655403

Structure Descriptors

InChI

1S/C8H6N4/c9-4-5-1-2-6-7(3-5)12-8(10)11-6/h1-3H,(H3,10,11,12)

InChIKey

PNMKRBOIMTZVLQ-UHFFFAOYSA-N

Smiles

n1c([nH]c2c1cc(C#N)cc2)N

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.13 (none)   EXP
Water Solubility 4110 mg/L 25 EST
Vapor Pressure 8.53E-08 mm Hg 25 EST
Henry's Law Constant 1.25E-12 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 5.21E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.