ChemSpider 2D Image | 3-Bromopyrazolo[1,5-a]pyrimidin-5(4H)-one | C6H4BrN3O

3-Bromopyrazolo[1,5-a]pyrimidin-5(4H)-one

  • Molecular FormulaC6H4BrN3O
  • Average mass214.020 Da
  • Monoisotopic mass212.953766 Da
  • ChemSpider ID24598169

More details:

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

1198569-35-5 [RN]
3-Bromopyrazolo[1,5-a]pyrimidin-5(4H)-one [ACD/IUPAC Name]
3-Bromopyrazolo[1,5-a]pyrimidin-5(4H)-one [French] [ACD/IUPAC Name]
3-Brompyrazolo[1,5-a]pyrimidin-5(4H)-on [German] [ACD/IUPAC Name]
Pyrazolo[1,5-a]pyrimidin-5(4H)-one, 3-bromo- [ACD/Index Name]
[1198569-35-5] [RN]
1394004-05-7 [RN]
3-bromo-4,8-dihydropyrazolo[1,5-a]pyrimidin-5-one
3-bromo-4H,5H-pyrazolo[1,5-a]pyrimidin-5-one
3-bromo-4H-pyrazolo[1,5-a]pyrimidin-5-one
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 2.1±0.1 g/cm3
    Boiling Point: 262.0±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 50.0±3.0 kJ/mol
    Flash Point: 112.3±27.3 °C
    Index of Refraction: 1.798
    Molar Refractivity: 43.6±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 0.11
    ACD/LogD (pH 5.5): 0.33
    ACD/BCF (pH 5.5): 1.05
    ACD/KOC (pH 5.5): 35.98
    ACD/LogD (pH 7.4): 0.33
    ACD/BCF (pH 7.4): 1.05
    ACD/KOC (pH 7.4): 35.94
    Polar Surface Area: 47 Å2
    Polarizability: 17.3±0.5 10-24cm3
    Surface Tension: 73.9±7.0 dyne/cm
    Molar Volume: 102.1±7.0 cm3

    Click to predict properties on the Chemicalize site


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