ChemSpider 2D Image | 1-(4-Fluorophenyl)-4-imino-1H-pyrazolo[3,4-d]pyrimidin-5(4H)-amine | C11H9FN6

1-(4-Fluorophenyl)-4-imino-1H-pyrazolo[3,4-d]pyrimidin-5(4H)-amine

  • Molecular FormulaC11H9FN6
  • Average mass244.228 Da
  • Monoisotopic mass244.087280 Da
  • ChemSpider ID35487296

More details:

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

1-(4-Fluorophenyl)-4-imino-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-amine [ACD/IUPAC Name]
1-(4-Fluorophényl)-4-imino-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-amine [French] [ACD/IUPAC Name]
1-(4-Fluorophenyl)-4-imino-1H-pyrazolo[3,4-d]pyrimidin-5(4H)-amine
1-(4-Fluorphenyl)-4-imino-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-amin [German] [ACD/IUPAC Name]
1416342-82-9 [RN]
5H-Pyrazolo[3,4-d]pyrimidin-5-amine, 1-(4-fluorophenyl)-1,4-dihydro-4-imino- [ACD/Index Name]
1-(4-Fluoro-phenyl)-4-imino-1,4-dihydro-pyrazolo[3,4-d]pyrimidin-5-ylamine
1-(4-fluorophenyl)-4-iminopyrazolo[3,4-d]pyrimidin-5-amine
MFCD22627631

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 426.2±51.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.1±3.0 kJ/mol
    Flash Point: 211.5±30.4 °C
    Index of Refraction: 1.775
    Molar Refractivity: 63.3±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 3
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -0.21
    ACD/LogD (pH 5.5): 0.32
    ACD/BCF (pH 5.5): 1.02
    ACD/KOC (pH 5.5): 35.38
    ACD/LogD (pH 7.4): 0.32
    ACD/BCF (pH 7.4): 1.02
    ACD/KOC (pH 7.4): 35.38
    Polar Surface Area: 83 Å2
    Polarizability: 25.1±0.5 10-24cm3
    Surface Tension: 68.9±7.0 dyne/cm
    Molar Volume: 151.7±7.0 cm3

    Click to predict properties on the Chemicalize site


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