ChemSpider 2D Image | 4-(Bromomethyl)-1-(4-chlorophenyl)-1H-1,2,3-triazole | C9H7BrClN3

4-(Bromomethyl)-1-(4-chlorophenyl)-1H-1,2,3-triazole

  • Molecular FormulaC9H7BrClN3
  • Average mass272.529 Da
  • Monoisotopic mass270.951172 Da
  • ChemSpider ID26052621

More details:

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

1H-1,2,3-Triazole, 4-(bromomethyl)-1-(4-chlorophenyl)- [ACD/Index Name]
4-(Brommethyl)-1-(4-chlorphenyl)-1H-1,2,3-triazol [German] [ACD/IUPAC Name]
4-(Bromomethyl)-1-(4-chlorophenyl)-1H-1,2,3-triazole [ACD/IUPAC Name]
4-(Bromométhyl)-1-(4-chlorophényl)-1H-1,2,3-triazole [French] [ACD/IUPAC Name]
1228182-70-4 [RN]
4-(bromomethyl)-1-(4-chlorophenyl)triazole
95%
bromomethylchlorophenyltriazole
EE-0726
MFCD16622800 [MDL number]

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

    Density: 1.7±0.1 g/cm3
    Boiling Point: 387.7±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 63.7±3.0 kJ/mol
    Flash Point: 188.2±30.7 °C
    Index of Refraction: 1.676
    Molar Refractivity: 61.1±0.5 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.10
    ACD/LogD (pH 5.5): 2.95
    ACD/BCF (pH 5.5): 102.99
    ACD/KOC (pH 5.5): 960.23
    ACD/LogD (pH 7.4): 2.95
    ACD/BCF (pH 7.4): 102.99
    ACD/KOC (pH 7.4): 960.23
    Polar Surface Area: 31 Å2
    Polarizability: 24.2±0.5 10-24cm3
    Surface Tension: 52.9±7.0 dyne/cm
    Molar Volume: 162.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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