ChemSpider 2D Image | 2,4-Diamino-6-chloro-5-pyrimidinecarbonitrile | C5H4ClN5

2,4-Diamino-6-chloro-5-pyrimidinecarbonitrile

  • Molecular FormulaC5H4ClN5
  • Average mass169.572 Da
  • Monoisotopic mass169.015518 Da
  • ChemSpider ID35515809

More details:

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

2,4-Diamino-6-chlor-5-pyrimidincarbonitril [German] [ACD/IUPAC Name]
2,4-Diamino-6-chloro-5-pyrimidinecarbonitrile [ACD/IUPAC Name]
2,4-Diamino-6-chloro-5-pyrimidinecarbonitrile [French] [ACD/IUPAC Name]
5-Pyrimidinecarbonitrile, 2,4-diamino-6-chloro- [ACD/Index Name]
2,4-diamino-6-chloropyrimidine-5-carbonitrile
2,4-Diamino-6-chloro-pyrimidine-5-carbonitrile
900456-21-5 [RN]
MFCD07761792

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 542.4±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 82.0±3.0 kJ/mol
    Flash Point: 281.8±32.9 °C
    Index of Refraction: 1.674
    Molar Refractivity: 39.0±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 4
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.48
    ACD/LogD (pH 5.5): 0.88
    ACD/BCF (pH 5.5): 2.72
    ACD/KOC (pH 5.5): 71.30
    ACD/LogD (pH 7.4): 0.88
    ACD/BCF (pH 7.4): 2.72
    ACD/KOC (pH 7.4): 71.30
    Polar Surface Area: 102 Å2
    Polarizability: 15.5±0.5 10-24cm3
    Surface Tension: 110.9±5.0 dyne/cm
    Molar Volume: 103.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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