ChemSpider 2D Image | 4'-Nitro-3-biphenylcarbonitrile | C13H8N2O2

4'-Nitro-3-biphenylcarbonitrile

  • Molecular FormulaC13H8N2O2
  • Average mass224.215 Da
  • Monoisotopic mass224.058578 Da
  • ChemSpider ID28535608

More details:

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

[1,1'-Biphenyl]-3-carbonitrile, 4'-nitro- [ACD/Index Name]
1352318-54-7 [RN]
4'-Nitro-3-biphenylcarbonitril [German] [ACD/IUPAC Name]
4'-Nitro-3-biphenylcarbonitrile [ACD/IUPAC Name]
4'-Nitro-3-biphénylcarbonitrile [French] [ACD/IUPAC Name]
[1352318-54-7] [RN]
3-(4-NITROPHENYL)BENZONITRILE
4'-Nitro[1,1'-biphenyl]-3-carbonitrile
4'-Nitro-[1,1'-biphenyl]-3-carbonitrile
LD-0165
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 404.6±28.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.6±3.0 kJ/mol
    Flash Point: 198.5±24.0 °C
    Index of Refraction: 1.641
    Molar Refractivity: 62.1±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.67
    ACD/LogD (pH 5.5): 3.43
    ACD/BCF (pH 5.5): 240.25
    ACD/KOC (pH 5.5): 1760.69
    ACD/LogD (pH 7.4): 3.43
    ACD/BCF (pH 7.4): 240.25
    ACD/KOC (pH 7.4): 1760.69
    Polar Surface Area: 70 Å2
    Polarizability: 24.6±0.5 10-24cm3
    Surface Tension: 61.8±5.0 dyne/cm
    Molar Volume: 172.0±5.0 cm3

    Click to predict properties on the Chemicalize site


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