ChemSpider 2D Image | 1-Cyclohexyl-2-methyl-1,3-benzodiazole-5-carbonitrile | C15H17N3

1-Cyclohexyl-2-methyl-1,3-benzodiazole-5-carbonitrile

  • Molecular FormulaC15H17N3
  • Average mass239.316 Da
  • Monoisotopic mass239.142242 Da
  • ChemSpider ID30782823

More details:

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

1403483-86-2 [RN]
1-Cyclohexyl-2-methyl-1,3-benzodiazole-5-carbonitrile
1-Cyclohexyl-2-methyl-1H-benzimidazol-5-carbonitril [German] [ACD/IUPAC Name]
1-Cyclohexyl-2-methyl-1H-benzimidazole-5-carbonitrile [ACD/IUPAC Name]
1-Cyclohexyl-2-méthyl-1H-benzimidazole-5-carbonitrile [French] [ACD/IUPAC Name]
1H-Benzimidazole-5-carbonitrile, 1-cyclohexyl-2-methyl- [ACD/Index Name]
[1403483-86-2] [RN]
MFCD22549340
WZ-9032

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 452.1±18.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 71.1±3.0 kJ/mol
    Flash Point: 227.3±21.2 °C
    Index of Refraction: 1.648
    Molar Refractivity: 72.8±0.5 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.48
    ACD/LogD (pH 5.5): 3.29
    ACD/BCF (pH 5.5): 175.44
    ACD/KOC (pH 5.5): 1319.66
    ACD/LogD (pH 7.4): 3.38
    ACD/BCF (pH 7.4): 218.51
    ACD/KOC (pH 7.4): 1643.64
    Polar Surface Area: 42 Å2
    Polarizability: 28.8±0.5 10-24cm3
    Surface Tension: 46.7±7.0 dyne/cm
    Molar Volume: 200.0±7.0 cm3

    Click to predict properties on the Chemicalize site


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