ChemSpider 2D Image | 1-[3-(Trifluoromethyl)phenyl]-1H-imidazole-5-carboxylic acid | C11H7F3N2O2

1-[3-(Trifluoromethyl)phenyl]-1H-imidazole-5-carboxylic acid

  • Molecular FormulaC11H7F3N2O2
  • Average mass256.181 Da
  • Monoisotopic mass256.045959 Da
  • ChemSpider ID27493508

More details:

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

1-[3-(Trifluormethyl)phenyl]-1H-imidazol-5-carbonsäure [German] [ACD/IUPAC Name]
1-[3-(Trifluoromethyl)phenyl]-1H-imidazole-5-carboxylic acid [ACD/IUPAC Name]
1779124-23-0 [RN]
1H-Imidazole-5-carboxylic acid, 1-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
Acide 1-[3-(trifluorométhyl)phényl]-1H-imidazole-5-carboxylique [French] [ACD/IUPAC Name]
1-(3-(Trifluoromethyl)phenyl)-1H-imidazole-5-carboxylic acid
3-[3-(TRIFLUOROMETHYL)PHENYL]IMIDAZOLE-4-CARBOXYLIC ACID
KS-8437
MFCD26097142

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 415.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 70.5±3.0 kJ/mol
    Flash Point: 205.0±28.7 °C
    Index of Refraction: 1.558
    Molar Refractivity: 57.0±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.23
    ACD/LogD (pH 5.5): 0.85
    ACD/BCF (pH 5.5): 1.04
    ACD/KOC (pH 5.5): 12.13
    ACD/LogD (pH 7.4): -0.49
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 55 Å2
    Polarizability: 22.6±0.5 10-24cm3
    Surface Tension: 41.9±7.0 dyne/cm
    Molar Volume: 176.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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