ChemSpider 2D Image | 2-Methyl-N-[3-(trifluoromethyl)phenyl]-1H-benzimidazole-5-carboxamide | C16H12F3N3O

2-Methyl-N-[3-(trifluoromethyl)phenyl]-1H-benzimidazole-5-carboxamide

  • Molecular FormulaC16H12F3N3O
  • Average mass319.281 Da
  • Monoisotopic mass319.093262 Da
  • ChemSpider ID29346943

More details:






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

1H-Benzimidazole-6-carboxamide, 2-methyl-N-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
2-Methyl-N-[3-(trifluormethyl)phenyl]-1H-benzimidazol-5-carboxamid [German] [ACD/IUPAC Name]
2-Methyl-N-[3-(trifluoromethyl)phenyl]-1H-benzimidazole-5-carboxamide [ACD/IUPAC Name]
2-Méthyl-N-[3-(trifluorométhyl)phényl]-1H-benzimidazole-5-carboxamide [French] [ACD/IUPAC Name]
1574309-69-5 [RN]
2-Methyl-1H-benzoimidazole-5-carboxylic acid (3-trifluoromethyl-phenyl)-amide
2-methyl-N-[3-(trifluoromethyl)phenyl]-3H-benzimidazole-5-carboxamide
AGN-PC-0JJB8I
AKOS022123970
AKOS024458854
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 417.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 67.1±3.0 kJ/mol
    Flash Point: 206.2±28.7 °C
    Index of Refraction: 1.644
    Molar Refractivity: 81.0±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.33
    ACD/LogD (pH 5.5): 3.20
    ACD/BCF (pH 5.5): 135.71
    ACD/KOC (pH 5.5): 964.44
    ACD/LogD (pH 7.4): 3.49
    ACD/BCF (pH 7.4): 264.19
    ACD/KOC (pH 7.4): 1877.58
    Polar Surface Area: 58 Å2
    Polarizability: 32.1±0.5 10-24cm3
    Surface Tension: 51.5±3.0 dyne/cm
    Molar Volume: 223.8±3.0 cm3

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