ChemSpider 2D Image | 3'-Ethynyl-3-biphenylcarbonitrile | C15H9N

3'-Ethynyl-3-biphenylcarbonitrile

  • Molecular FormulaC15H9N
  • Average mass203.239 Da
  • Monoisotopic mass203.073502 Da
  • ChemSpider ID32058300

More details:

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

[1,1'-Biphenyl]-3-carbonitrile, 3'-ethynyl- [ACD/Index Name]
3'-Ethinyl-3-biphenylcarbonitril [German] [ACD/IUPAC Name]
3'-Ethynyl-3-biphenylcarbonitrile [ACD/IUPAC Name]
3'-Éthynyl-3-biphénylcarbonitrile [French] [ACD/IUPAC Name]
1245642-07-2 [RN]
3-ethynyl-[1,1-biphenyl]-3-carbonitrile
3'-Ethynyl-[1,1'-biphenyl]-3-carbonitrile
MFCD23132771

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 374.6±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 62.2±3.0 kJ/mol
    Flash Point: 181.4±18.4 °C
    Index of Refraction: 1.629
    Molar Refractivity: 63.1±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 4.23
    ACD/LogD (pH 5.5): 3.83
    ACD/BCF (pH 5.5): 476.27
    ACD/KOC (pH 5.5): 2873.48
    ACD/LogD (pH 7.4): 3.83
    ACD/BCF (pH 7.4): 476.27
    ACD/KOC (pH 7.4): 2873.48
    Polar Surface Area: 24 Å2
    Polarizability: 25.0±0.5 10-24cm3
    Surface Tension: 54.8±5.0 dyne/cm
    Molar Volume: 177.5±5.0 cm3

    Click to predict properties on the Chemicalize site


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