ChemSpider 2D Image | 3-Phenyl-2-pyrazinecarbonitrile | C11H7N3

3-Phenyl-2-pyrazinecarbonitrile

  • Molecular FormulaC11H7N3
  • Average mass181.193 Da
  • Monoisotopic mass181.063995 Da
  • ChemSpider ID22499599

More details:

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

2882-16-8 [RN]
2-Pyrazinecarbonitrile, 3-phenyl- [ACD/Index Name]
3-Phenyl-2-pyrazincarbonitril [German] [ACD/IUPAC Name]
3-Phenyl-2-pyrazinecarbonitrile [ACD/IUPAC Name]
3-Phényl-2-pyrazinecarbonitrile [French] [ACD/IUPAC Name]
3-phenylpyrazine-2-carbonitrile
2-Cyano-3-phenylpyrazine
3-Phenyl-pyrazine-2-carbonitrile
AKOS006303691
AS-5599
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 365.0±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.1±3.0 kJ/mol
    Flash Point: 125.4±13.1 °C
    Index of Refraction: 1.625
    Molar Refractivity: 51.6±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.75
    ACD/LogD (pH 5.5): 1.45
    ACD/BCF (pH 5.5): 7.42
    ACD/KOC (pH 5.5): 146.06
    ACD/LogD (pH 7.4): 1.45
    ACD/BCF (pH 7.4): 7.42
    ACD/KOC (pH 7.4): 146.06
    Polar Surface Area: 50 Å2
    Polarizability: 20.5±0.5 10-24cm3
    Surface Tension: 65.9±5.0 dyne/cm
    Molar Volume: 146.1±5.0 cm3

    Click to predict properties on the Chemicalize site


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