ChemSpider 2D Image | 4-Bromo-1,5-diphenyl-1H-1,2,3-triazole | C14H10BrN3

4-Bromo-1,5-diphenyl-1H-1,2,3-triazole

  • Molecular FormulaC14H10BrN3
  • Average mass300.153 Da
  • Monoisotopic mass299.005798 Da
  • ChemSpider ID34485532

More details:






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

1H-1,2,3-Triazole, 4-bromo-1,5-diphenyl- [ACD/Index Name]
4-Brom-1,5-diphenyl-1H-1,2,3-triazol [German] [ACD/IUPAC Name]
4-Bromo-1,5-diphenyl-1H-1,2,3-triazole [ACD/IUPAC Name]
4-Bromo-1,5-diphényl-1H-1,2,3-triazole [French] [ACD/IUPAC Name]
1858250-37-9 [RN]
4-bromo-1,5-diphenyltriazole
MFCD28505093

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 443.6±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.1±3.0 kJ/mol
    Flash Point: 222.1±26.5 °C
    Index of Refraction: 1.674
    Molar Refractivity: 77.0±0.5 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 4.13
    ACD/LogD (pH 5.5): 3.86
    ACD/BCF (pH 5.5): 505.47
    ACD/KOC (pH 5.5): 2998.53
    ACD/LogD (pH 7.4): 3.86
    ACD/BCF (pH 7.4): 505.47
    ACD/KOC (pH 7.4): 2998.53
    Polar Surface Area: 31 Å2
    Polarizability: 30.5±0.5 10-24cm3
    Surface Tension: 50.7±7.0 dyne/cm
    Molar Volume: 205.2±7.0 cm3

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