ChemSpider 2D Image | 3-(3-Fluorophenyl)-5-phenyl-1H-1,2,4-triazole | C14H10FN3

3-(3-Fluorophenyl)-5-phenyl-1H-1,2,4-triazole

  • Molecular FormulaC14H10FN3
  • Average mass239.248 Da
  • Monoisotopic mass239.085876 Da
  • ChemSpider ID23376942

More details:

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

1211788-82-7 [RN]
1H-1,2,4-Triazole, 5-(3-fluorophenyl)-3-phenyl- [ACD/Index Name]
3-(3-Fluorophenyl)-5-phenyl-1H-1,2,4-triazole [ACD/IUPAC Name]
3-(3-Fluorophényl)-5-phényl-1H-1,2,4-triazole [French] [ACD/IUPAC Name]
3-(3-Fluorphenyl)-5-phenyl-1H-1,2,4-triazol [German] [ACD/IUPAC Name]
5-(3-Fluorophenyl)-3-phenyl-1H-1,2,4-triazole
5-(3-Fluoro-phenyl)-3-phenyl-1H-[1,2,4]triazole
AKOS002684316
MFCD13452448

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 444.1±47.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.2±3.0 kJ/mol
    Flash Point: 222.4±29.3 °C
    Index of Refraction: 1.616
    Molar Refractivity: 66.0±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 4.15
    ACD/LogD (pH 5.5): 3.51
    ACD/BCF (pH 5.5): 275.96
    ACD/KOC (pH 5.5): 1944.07
    ACD/LogD (pH 7.4): 3.51
    ACD/BCF (pH 7.4): 271.70
    ACD/KOC (pH 7.4): 1914.07
    Polar Surface Area: 42 Å2
    Polarizability: 26.2±0.5 10-24cm3
    Surface Tension: 52.6±3.0 dyne/cm
    Molar Volume: 189.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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