ChemSpider 2D Image | 3-Bromo-5-cyanobenzyl bromide | C8H5Br2N

3-Bromo-5-cyanobenzyl bromide

  • Molecular FormulaC8H5Br2N
  • Average mass274.940 Da
  • Monoisotopic mass272.878845 Da
  • ChemSpider ID26556128

More details:

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

124289-24-3 [RN]
3-Brom-5-(brommethyl)benzonitril [German] [ACD/IUPAC Name]
3-Bromo-5-(bromomethyl)benzonitrile [ACD/IUPAC Name]
3-Bromo-5-(bromométhyl)benzonitrile [French] [ACD/IUPAC Name]
3-Bromo-5-cyanobenzyl bromide
Benzonitrile, 3-bromo-5-(bromomethyl)- [ACD/Index Name]
3-Bromo-4-(Bromomethyl)benzonitrile (en)
89892-39-7 [RN]
Benzonitrile,3-bromo-5-(bromomethyl)-
MFCD09261038

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

    Density: 1.9±0.1 g/cm3
    Boiling Point: 313.6±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 55.5±3.0 kJ/mol
    Flash Point: 143.5±23.7 °C
    Index of Refraction: 1.639
    Molar Refractivity: 51.4±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.84
    ACD/LogD (pH 5.5): 3.35
    ACD/BCF (pH 5.5): 205.10
    ACD/KOC (pH 5.5): 1572.21
    ACD/LogD (pH 7.4): 3.35
    ACD/BCF (pH 7.4): 205.10
    ACD/KOC (pH 7.4): 1572.21
    Polar Surface Area: 24 Å2
    Polarizability: 20.4±0.5 10-24cm3
    Surface Tension: 58.7±5.0 dyne/cm
    Molar Volume: 142.8±5.0 cm3

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