ChemSpider 2D Image | 7-Chloro-5-cyclobutyl-1,3-dimethyl-1H-pyrazolo[4,3-d]pyrimidine | C11H13ClN4

7-Chloro-5-cyclobutyl-1,3-dimethyl-1H-pyrazolo[4,3-d]pyrimidine

  • Molecular FormulaC11H13ClN4
  • Average mass236.701 Da
  • Monoisotopic mass236.082870 Da
  • ChemSpider ID24796447

More details:

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

1239783-12-0 [RN]
1H-Pyrazolo[4,3-d]pyrimidine, 7-chloro-5-cyclobutyl-1,3-dimethyl- [ACD/Index Name]
7-Chlor-5-cyclobutyl-1,3-dimethyl-1H-pyrazolo[4,3-d]pyrimidin [German] [ACD/IUPAC Name]
7-Chloro-5-cyclobutyl-1,3-dimethyl-1H-pyrazolo[4,3-d]pyrimidine [ACD/IUPAC Name]
7-Chloro-5-cyclobutyl-1,3-diméthyl-1H-pyrazolo[4,3-d]pyrimidine [French] [ACD/IUPAC Name]
7-chloro-5-cyclobutyl-1,3-dimethylpyrazolo[4,3-d]pyrimidine
MFCD14704955

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 304.4±24.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 52.3±3.0 kJ/mol
    Flash Point: 137.9±22.9 °C
    Index of Refraction: 1.736
    Molar Refractivity: 62.9±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.72
    ACD/LogD (pH 5.5): 2.62
    ACD/BCF (pH 5.5): 57.35
    ACD/KOC (pH 5.5): 631.42
    ACD/LogD (pH 7.4): 2.62
    ACD/BCF (pH 7.4): 57.38
    ACD/KOC (pH 7.4): 631.75
    Polar Surface Area: 44 Å2
    Polarizability: 25.0±0.5 10-24cm3
    Surface Tension: 52.6±7.0 dyne/cm
    Molar Volume: 156.7±7.0 cm3

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