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Search term: MF = 'C_{9}H_{12}N_{4}'
ChemSpider 2D Image | 2-(Diethylamino)-4-pyrimidinecarbonitrile | C9H12N4

2-(Diethylamino)-4-pyrimidinecarbonitrile

  • Molecular FormulaC9H12N4
  • Average mass176.218 Da
  • Monoisotopic mass176.106201 Da
  • ChemSpider ID25076975

More details:

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

2-(Diethylamino)-4-pyrimidincarbonitril [German] [ACD/IUPAC Name]
2-(Diethylamino)-4-pyrimidinecarbonitrile [ACD/IUPAC Name]
2-(Diéthylamino)-4-pyrimidinecarbonitrile [French] [ACD/IUPAC Name]
2-(diethylamino)pyrimidine-4-carbonitrile
4-Pyrimidinecarbonitrile, 2-(diethylamino)- [ACD/Index Name]
75825-49-9 [RN]
[75825-49-9] [RN]
95%
diethylaminopyrimidinecarbonitrile
MFCD15202259 [MDL number]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 319.3±34.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.1±3.0 kJ/mol
    Flash Point: 146.9±25.7 °C
    Index of Refraction: 1.537
    Molar Refractivity: 49.3±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.39
    ACD/LogD (pH 5.5): 1.35
    ACD/BCF (pH 5.5): 6.20
    ACD/KOC (pH 5.5): 128.52
    ACD/LogD (pH 7.4): 1.35
    ACD/BCF (pH 7.4): 6.20
    ACD/KOC (pH 7.4): 128.55
    Polar Surface Area: 53 Å2
    Polarizability: 19.5±0.5 10-24cm3
    Surface Tension: 54.3±5.0 dyne/cm
    Molar Volume: 158.0±5.0 cm3

    Click to predict properties on the Chemicalize site


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