ChemSpider 2D Image | 1H-Benzimidazole-2,5,6-triamine | C7H9N5

1H-Benzimidazole-2,5,6-triamine

  • Molecular FormulaC7H9N5
  • Average mass163.180 Da
  • Monoisotopic mass163.085800 Da
  • ChemSpider ID23980366

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1H-Benzimidazol-2,5,6-triamin [German] [ACD/IUPAC Name]
1H-Benzimidazole-2,5,6-triamine [ACD/Index Name] [ACD/IUPAC Name]
1H-Benzimidazole-2,5,6-triamine [French] [ACD/Index Name] [ACD/IUPAC Name]
1H-benzo[d]imidazole-2,5,6-triamine
934333-22-9 [RN]
2,5,6-triamino-1h-benzimidazole
Ethyl 4-methyl-1H-imidazole-2-carboxylate [ACD/IUPAC Name]
MFCD18807755 [MDL number]

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.6±0.1 g/cm3
    Boiling Point: 547.4±53.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 82.7±3.0 kJ/mol
    Flash Point: 318.8±18.1 °C
    Index of Refraction: 1.953
    Molar Refractivity: 49.3±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 7
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 1
    ACD/LogP: -1.39
    ACD/LogD (pH 5.5): -3.13
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.99
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 107 Å2
    Polarizability: 19.6±0.5 10-24cm3
    Surface Tension: 127.2±3.0 dyne/cm
    Molar Volume: 101.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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