ChemSpider 2D Image | 5-Ethynylpicolinonitrile | C8H4N2

5-Ethynylpicolinonitrile

  • Molecular FormulaC8H4N2
  • Average mass128.131 Da
  • Monoisotopic mass128.037445 Da
  • ChemSpider ID27474586

More details:

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

1211584-19-8 [RN]
2-Pyridinecarbonitrile, 5-ethynyl- [ACD/Index Name]
5-Ethinyl-2-pyridincarbonitril [German] [ACD/IUPAC Name]
5-Ethynyl-2-pyridinecarbonitrile [ACD/IUPAC Name]
5-Éthynyl-2-pyridinecarbonitrile [French] [ACD/IUPAC Name]
5-Ethynylpicolinonitrile
2-Cyano-5-ethynylpyridine
5-Ethynylpicolinonitrile, 2-Cyano-5-ethynylpyridine
5-Ethynylpicolinonitrile; 2-Cyano-5-ethynylpyridine
5-Ethynylpyridine-2-carbonitrile
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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: 269.2±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 50.7±3.0 kJ/mol
    Flash Point: 102.0±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: 0.69
    ACD/LogD (pH 5.5): 0.65
    ACD/BCF (pH 5.5): 1.83
    ACD/KOC (pH 5.5): 53.56
    ACD/LogD (pH 7.4): 0.65
    ACD/BCF (pH 7.4): 1.83
    ACD/KOC (pH 7.4): 53.56
    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

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