ChemSpider 2D Image | 4-Cyanonicotinic acid | C7H4N2O2

4-Cyanonicotinic acid

  • Molecular FormulaC7H4N2O2
  • Average mass148.119 Da
  • Monoisotopic mass148.027283 Da
  • ChemSpider ID24224653

More details:

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

3-Pyridinecarboxylic acid, 4-cyano- [ACD/Index Name]
4-Cyannicotinsäure [German] [ACD/IUPAC Name]
4-Cyanonicotinic acid [ACD/IUPAC Name]
4-Cyanopyridine-3-carboxylic acid
827616-51-3 [RN]
Acide 4-cyanonicotinique [French] [ACD/IUPAC Name]
[827616-51-3] [RN]
3-pyridinecarboxylic acid,4-cyano-
3-PYRIDINECARBOXYLICACID, 4-CYANO-
4-cyano-3-Pyridine carbocylic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 364.1±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.4±3.0 kJ/mol
    Flash Point: 174.0±23.7 °C
    Index of Refraction: 1.597
    Molar Refractivity: 35.4±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.40
    ACD/LogD (pH 5.5): -2.58
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.92
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 74 Å2
    Polarizability: 14.0±0.5 10-24cm3
    Surface Tension: 78.2±5.0 dyne/cm
    Molar Volume: 103.9±5.0 cm3

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