ChemSpider 2D Image | 3-Formylisonicotinonitrile | C7H4N2O

3-Formylisonicotinonitrile

  • Molecular FormulaC7H4N2O
  • Average mass132.120 Da
  • Monoisotopic mass132.032364 Da
  • ChemSpider ID28420148

More details:

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

1211582-43-2 [RN]
3-Formylisonicotinonitril [German] [ACD/IUPAC Name]
3-Formylisonicotinonitrile [ACD/IUPAC Name]
3-Formylisonicotinonitrile [French] [ACD/IUPAC Name]
4-Pyridinecarbonitrile, 3-formyl- [ACD/Index Name]
3-Formylpyridine-4-carbonitrile
MFCD18251025

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 304.0±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 54.4±3.0 kJ/mol
    Flash Point: 137.7±23.7 °C
    Index of Refraction: 1.554
    Molar Refractivity: 34.1±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.62
    ACD/LogD (pH 5.5): 0.33
    ACD/BCF (pH 5.5): 1.04
    ACD/KOC (pH 5.5): 35.92
    ACD/LogD (pH 7.4): 0.33
    ACD/BCF (pH 7.4): 1.04
    ACD/KOC (pH 7.4): 35.92
    Polar Surface Area: 54 Å2
    Polarizability: 13.5±0.5 10-24cm3
    Surface Tension: 59.7±5.0 dyne/cm
    Molar Volume: 106.4±5.0 cm3

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