ChemSpider 2D Image | 4,6-Dichloro-1-(3-methoxybenzyl)-1H-pyrazolo[3,4-d]pyrimidine | C13H10Cl2N4O

4,6-Dichloro-1-(3-methoxybenzyl)-1H-pyrazolo[3,4-d]pyrimidine

  • Molecular FormulaC13H10Cl2N4O
  • Average mass309.151 Da
  • Monoisotopic mass308.023163 Da
  • ChemSpider ID24540639

More details:

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

1184913-85-6 [RN]
1H-Pyrazolo[3,4-d]pyrimidine, 4,6-dichloro-1-[(3-methoxyphenyl)methyl]- [ACD/Index Name]
4,6-Dichlor-1-(3-methoxybenzyl)-1H-pyrazolo[3,4-d]pyrimidin [German] [ACD/IUPAC Name]
4,6-Dichloro-1-(3-methoxybenzyl)-1H-pyrazolo[3,4-d]pyrimidine [ACD/IUPAC Name]
4,6-Dichloro-1-(3-méthoxybenzyl)-1H-pyrazolo[3,4-d]pyrimidine [French] [ACD/IUPAC Name]
1-(3-methoxybenzyl)-4,6-dichloro-1H-pyrazolo[3,4-d]pyrimidine
3-[(4,6-dichloropyrazolo[5,4-d]pyrimidinyl)methyl]-1-methoxybenzene
4,6-dichloro-1-(3-methoxybenzyl)-1H-pyrazolo[3,4-d]pyrimidine(WX130394)
4,6-dichloro-1-[(3-methoxyphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidine

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 447.0±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 67.8±3.0 kJ/mol
    Flash Point: 224.1±28.7 °C
    Index of Refraction: 1.687
    Molar Refractivity: 78.3±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.06
    ACD/LogD (pH 5.5): 3.26
    ACD/BCF (pH 5.5): 177.40
    ACD/KOC (pH 5.5): 1417.14
    ACD/LogD (pH 7.4): 3.26
    ACD/BCF (pH 7.4): 177.40
    ACD/KOC (pH 7.4): 1417.14
    Polar Surface Area: 53 Å2
    Polarizability: 31.1±0.5 10-24cm3
    Surface Tension: 53.0±7.0 dyne/cm
    Molar Volume: 205.6±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement