ChemSpider 2D Image | 2-Ethynylisonicotinonitrile | C8H4N2

2-Ethynylisonicotinonitrile

  • Molecular FormulaC8H4N2
  • Average mass128.131 Da
  • Monoisotopic mass128.037445 Da
  • ChemSpider ID30648802

More details:

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

1211580-87-8 [RN]
2-Ethinylisonicotinonitril [German] [ACD/IUPAC Name]
2-Ethynyl-4-pyridinecarbonitrile
2-Ethynylisonicotinonitrile [ACD/IUPAC Name]
2-Éthynylisonicotinonitrile [French] [ACD/IUPAC Name]
2-ethynylpyridine-4-carbonitrile
4-Pyridinecarbonitrile, 2-ethynyl- [ACD/Index Name]
2-Ethynyl-isonicotinonitrile
AJ-136861
AK-43348
More...

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 236.1±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 47.3±3.0 kJ/mol
    Flash Point: 93.4±8.3 °C
    Index of Refraction: 1.569
    Molar Refractivity: 36.2±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.59
    ACD/LogD (pH 5.5): 0.82
    ACD/BCF (pH 5.5): 2.48
    ACD/KOC (pH 5.5): 66.61
    ACD/LogD (pH 7.4): 0.82
    ACD/BCF (pH 7.4): 2.48
    ACD/KOC (pH 7.4): 66.61
    Polar Surface Area: 37 Å2
    Polarizability: 14.3±0.5 10-24cm3
    Surface Tension: 59.2±5.0 dyne/cm
    Molar Volume: 110.5±5.0 cm3

    Click to predict properties on the Chemicalize site


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