ChemSpider 2D Image | 3-Iodo-6-methyl-1H-pyrazolo[3,4-d]pyrimidine | C6H5IN4

3-Iodo-6-methyl-1H-pyrazolo[3,4-d]pyrimidine

  • Molecular FormulaC6H5IN4
  • Average mass260.035 Da
  • Monoisotopic mass259.955872 Da
  • ChemSpider ID29211875

More details:

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

1415559-47-5 [RN]
1H-Pyrazolo[3,4-d]pyrimidine, 3-iodo-6-methyl- [ACD/Index Name]
3-Iod-6-methyl-1H-pyrazolo[3,4-d]pyrimidin [German] [ACD/IUPAC Name]
3-Iodo-6-methyl-1H-pyrazolo[3,4-d]pyrimidine [ACD/IUPAC Name]
3-Iodo-6-méthyl-1H-pyrazolo[3,4-d]pyrimidine [French] [ACD/IUPAC Name]
3-iodo-6-methyl-2H-pyrazolo[3,4-d]pyrimidine
CS-13491
MFCD22571215

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

    Density: 2.2±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.785
    Molar Refractivity: 50.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 0.95
    ACD/LogD (pH 5.5): 0.91
    ACD/BCF (pH 5.5): 2.74
    ACD/KOC (pH 5.5): 66.98
    ACD/LogD (pH 7.4): -0.25
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 4.62
    Polar Surface Area: 54 Å2
    Polarizability: 20.0±0.5 10-24cm3
    Surface Tension: 87.2±3.0 dyne/cm
    Molar Volume: 119.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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