ChemSpider 2D Image | 6-Chloro-N-(3-chloro-4-methylphenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine | C13H11Cl2N5

6-Chloro-N-(3-chloro-4-methylphenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine

  • Molecular FormulaC13H11Cl2N5
  • Average mass308.166 Da
  • Monoisotopic mass307.039154 Da
  • ChemSpider ID22219930

More details:

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

1040662-70-1 [RN]
1H-Pyrazolo[3,4-d]pyrimidin-4-amine, 6-chloro-N-(3-chloro-4-methylphenyl)-1-methyl- [ACD/Index Name]
6-Chlor-N-(3-chlor-4-methylphenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amin [German] [ACD/IUPAC Name]
6-Chloro-N-(3-chloro-4-methylphenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine [ACD/IUPAC Name]
6-Chloro-N-(3-chloro-4-méthylphényl)-1-méthyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine [French] [ACD/IUPAC Name]
(3-Chloro-4-methyl-phenyl)-(6-chloro-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-amine
6-chloro-N-(3-chloro-4-methylphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
AGN-PC-059HBZ
AKOS005720285
BBL001705
More...

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 452.7±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 71.2±3.0 kJ/mol
    Flash Point: 227.6±28.7 °C
    Index of Refraction: 1.716
    Molar Refractivity: 79.8±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 4.24
    ACD/LogD (pH 5.5): 3.88
    ACD/BCF (pH 5.5): 519.78
    ACD/KOC (pH 5.5): 3058.65
    ACD/LogD (pH 7.4): 3.88
    ACD/BCF (pH 7.4): 520.00
    ACD/KOC (pH 7.4): 3059.98
    Polar Surface Area: 56 Å2
    Polarizability: 31.6±0.5 10-24cm3
    Surface Tension: 53.1±7.0 dyne/cm
    Molar Volume: 202.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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