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Search term: MF = 'C_{13}H_{8}BrNO'

ChemSpider 2D Image | 4-(3-Bromophenoxy)benzonitrile | C13H8BrNO

4-(3-Bromophenoxy)benzonitrile

  • Molecular FormulaC13H8BrNO
  • Average mass274.113 Da
  • Monoisotopic mass272.978912 Da
  • ChemSpider ID24367307

More details:






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

4-(3-Bromophenoxy)benzonitrile [ACD/IUPAC Name]
4-(3-Bromophénoxy)benzonitrile [French] [ACD/IUPAC Name]
4-(3-Bromphenoxy)benzonitril [German] [ACD/IUPAC Name]
Benzonitrile, 4-(3-bromophenoxy)- [ACD/Index Name]
[155866-71-0] [RN]
155866-71-0 [RN]
MFCD11135484

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 371.5±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.8±3.0 kJ/mol
    Flash Point: 178.5±23.7 °C
    Index of Refraction: 1.650
    Molar Refractivity: 65.5±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 4.90
    ACD/LogD (pH 5.5): 4.64
    ACD/BCF (pH 5.5): 1994.98
    ACD/KOC (pH 5.5): 8011.11
    ACD/LogD (pH 7.4): 4.64
    ACD/BCF (pH 7.4): 1994.98
    ACD/KOC (pH 7.4): 8011.11
    Polar Surface Area: 33 Å2
    Polarizability: 26.0±0.5 10-24cm3
    Surface Tension: 58.5±5.0 dyne/cm
    Molar Volume: 179.5±5.0 cm3

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