ChemSpider 2D Image | 1-(3-Bromophenyl)cyclopropanecarbonitrile | C10H8BrN

1-(3-Bromophenyl)cyclopropanecarbonitrile

  • Molecular FormulaC10H8BrN
  • Average mass222.081 Da
  • Monoisotopic mass220.984009 Da
  • ChemSpider ID14676099

More details:

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

1-(3-Bromophenyl)cyclopropanecarbonitrile [ACD/IUPAC Name]
1-(3-Bromophényl)cyclopropanecarbonitrile [French] [ACD/IUPAC Name]
1-(3-Bromphenyl)cyclopropancarbonitril [German] [ACD/IUPAC Name]
124276-83-1 [RN]
Cyclopropanecarbonitrile, 1-(3-bromophenyl)- [ACD/Index Name]
MFCD07374414 [MDL number]
[124276-83-1] [RN]
1-(3-bromophenyl)cyclopropane-1-carbonitrile
1-(3-Bromo-phenyl)cyclopropanecarbonitrile
1-(3-BROMO-PHENYL)-CYCLOPROPANECARBONITRILE
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 334.3±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.7±3.0 kJ/mol
    Flash Point: 156.0±25.9 °C
    Index of Refraction: 1.623
    Molar Refractivity: 50.9±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.31
    ACD/LogD (pH 5.5): 3.06
    ACD/BCF (pH 5.5): 125.42
    ACD/KOC (pH 5.5): 1105.66
    ACD/LogD (pH 7.4): 3.06
    ACD/BCF (pH 7.4): 125.42
    ACD/KOC (pH 7.4): 1105.66
    Polar Surface Area: 24 Å2
    Polarizability: 20.2±0.5 10-24cm3
    Surface Tension: 54.0±5.0 dyne/cm
    Molar Volume: 144.3±5.0 cm3

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