ChemSpider 2D Image | 7-Chloro-3-phenyl-1H-pyrazolo[4,3-d]pyrimidine | C11H7ClN4

7-Chloro-3-phenyl-1H-pyrazolo[4,3-d]pyrimidine

  • Molecular FormulaC11H7ClN4
  • Average mass230.653 Da
  • Monoisotopic mass230.035919 Da
  • ChemSpider ID28599915

More details:

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

1211588-84-9 [RN]
1H-Pyrazolo[4,3-d]pyrimidine, 7-chloro-3-phenyl- [ACD/Index Name]
7-Chlor-3-phenyl-1H-pyrazolo[4,3-d]pyrimidin [German] [ACD/IUPAC Name]
7-Chloro-3-phenyl-1H-pyrazolo[4,3-d]pyrimidine [ACD/IUPAC Name]
7-Chloro-3-phényl-1H-pyrazolo[4,3-d]pyrimidine [French] [ACD/IUPAC Name]
MFCD18254697 [MDL number]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 462.1±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 69.5±3.0 kJ/mol
    Flash Point: 265.7±12.9 °C
    Index of Refraction: 1.714
    Molar Refractivity: 62.3±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.96
    ACD/LogD (pH 5.5): 2.35
    ACD/BCF (pH 5.5): 30.49
    ACD/KOC (pH 5.5): 327.68
    ACD/LogD (pH 7.4): 1.00
    ACD/BCF (pH 7.4): 1.34
    ACD/KOC (pH 7.4): 14.44
    Polar Surface Area: 54 Å2
    Polarizability: 24.7±0.5 10-24cm3
    Surface Tension: 71.9±3.0 dyne/cm
    Molar Volume: 158.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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