ChemSpider 2D Image | N',N'-dimethyl-N-[1-(m-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]ethane-1,2-diamine | C16H20N6

N',N'-dimethyl-N-[1-(m-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]ethane-1,2-diamine

  • Molecular FormulaC16H20N6
  • Average mass296.370 Da
  • Monoisotopic mass296.174957 Da
  • ChemSpider ID21595763

More details:

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

405910-05-6 [RN]
N,N-Dimethyl-N'-(1-m-tolyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-ethane-1,2-diamine
N,N-dimethyl-N'-[1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]ethane-1,2-diamine
N',N'-dimethyl-N-[1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]ethane-1,2-diamine

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 441.5±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 69.9±3.0 kJ/mol
    Flash Point: 220.8±28.7 °C
    Index of Refraction: 1.648
    Molar Refractivity: 88.2±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.62
    ACD/LogD (pH 5.5): -0.68
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.42
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 5.35
    Polar Surface Area: 59 Å2
    Polarizability: 35.0±0.5 10-24cm3
    Surface Tension: 46.3±7.0 dyne/cm
    Molar Volume: 242.5±7.0 cm3

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