ChemSpider 2D Image | 1,2,2,3-Propanetetracarbonitrile | C7H4N4

1,2,2,3-Propanetetracarbonitrile

  • Molecular FormulaC7H4N4
  • Average mass144.133 Da
  • Monoisotopic mass144.043594 Da
  • ChemSpider ID24589325

More details:

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

1,2,2,3-Propanetetracarbonitrile [ACD/Index Name] [ACD/IUPAC Name]
1,2,2,3-Propanetétracarbonitrile [French] [ACD/IUPAC Name]
1,2,2,3-Propantetracarbonitril [German] [ACD/IUPAC Name]
1274904-48-1 [RN]
Propane-1,2,2,3-tetracarbonitrile
[1274904-48-1] [RN]
96%
MFCD10000963

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 499.6±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 76.8±3.0 kJ/mol
    Flash Point: 274.2±21.2 °C
    Index of Refraction: 1.491
    Molar Refractivity: 34.1±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: -0.23
    ACD/LogD (pH 5.5): -0.17
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 19.38
    ACD/LogD (pH 7.4): -0.17
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 19.38
    Polar Surface Area: 95 Å2
    Polarizability: 13.5±0.5 10-24cm3
    Surface Tension: 68.8±3.0 dyne/cm
    Molar Volume: 117.7±3.0 cm3

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