ChemSpider 2D Image | 4-amino-2-(dimethylamino)-5-pyrimidinecarbonitrile | C7H9N5

4-amino-2-(dimethylamino)-5-pyrimidinecarbonitrile

  • Molecular FormulaC7H9N5
  • Average mass163.180 Da
  • Monoisotopic mass163.085800 Da
  • ChemSpider ID26231651

More details:






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

13593-31-2 [RN]
4-Amino-2-(dimethylamino)-5-pyrimidincarbonitril [German] [ACD/IUPAC Name]
4-amino-2-(dimethylamino)-5-pyrimidinecarbonitrile [ACD/IUPAC Name]
4-Amino-2-(diméthylamino)-5-pyrimidinecarbonitrile [French] [ACD/IUPAC Name]
4-amino-2-(dimethylamino)pyrimidine-5-carbonitrile
5-Pyrimidinecarbonitrile, 4-amino-2-(dimethylamino)- [ACD/Index Name]
[13593-31-2] [RN]
4-Amino-2-dimethylamino-pyrimidine-5-carbonitrile
MFCD12195870

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 381.6±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 63.0±3.0 kJ/mol
    Flash Point: 184.6±30.7 °C
    Index of Refraction: 1.595
    Molar Refractivity: 43.7±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.22
    ACD/LogD (pH 5.5): 1.21
    ACD/BCF (pH 5.5): 4.83
    ACD/KOC (pH 5.5): 105.88
    ACD/LogD (pH 7.4): 1.23
    ACD/BCF (pH 7.4): 5.07
    ACD/KOC (pH 7.4): 111.18
    Polar Surface Area: 79 Å2
    Polarizability: 17.3±0.5 10-24cm3
    Surface Tension: 73.9±5.0 dyne/cm
    Molar Volume: 128.5±5.0 cm3

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