ChemSpider 2D Image | 3-benzyl-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-4-amine | C16H19N5

3-benzyl-1-tert-butyl-pyrazolo[3,4-d]pyrimidin-4-amine

  • Molecular FormulaC16H19N5
  • Average mass281.356 Da
  • Monoisotopic mass281.164032 Da
  • ChemSpider ID28468683

More details:

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

1-(1,1-Dimethylethyl)-3-(phenylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
186895-85-2 [RN]
1-B-PP1
1H-Pyrazolo[3,4-d]pyrimidin-4-amine, 1-(1,1-dimethylethyl)-3-(phenylmethyl)- [ACD/Index Name]
3-Benzyl-1-(2-methyl-2-propanyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amin [German] [ACD/IUPAC Name]
3-Benzyl-1-(2-methyl-2-propanyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine [ACD/IUPAC Name]
3-Benzyl-1-(2-méthyl-2-propanyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine [French] [ACD/IUPAC Name]
3-Benzyl-1-(tert-butyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
3-Benzyl-1-tert-butyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
3-benzyl-1-tert-butylpyrazolo[3,4-d]pyrimidin-4-amine
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 463.8±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.5±3.0 kJ/mol
    Flash Point: 234.3±27.3 °C
    Index of Refraction: 1.651
    Molar Refractivity: 83.6±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.73
    ACD/LogD (pH 5.5): 3.24
    ACD/BCF (pH 5.5): 161.95
    ACD/KOC (pH 5.5): 1251.65
    ACD/LogD (pH 7.4): 3.33
    ACD/BCF (pH 7.4): 198.69
    ACD/KOC (pH 7.4): 1535.64
    Polar Surface Area: 70 Å2
    Polarizability: 33.2±0.5 10-24cm3
    Surface Tension: 47.2±7.0 dyne/cm
    Molar Volume: 229.1±7.0 cm3

    Click to predict properties on the Chemicalize site


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