ChemSpider 2D Image | ethyl 7-bromo-2H,3H-pyrazolo[3,2-b][1,3]oxazole-6-carboxylate | C8H9BrN2O3

ethyl 7-bromo-2H,3H-pyrazolo[3,2-b][1,3]oxazole-6-carboxylate

  • Molecular FormulaC8H9BrN2O3
  • Average mass261.073 Da
  • Monoisotopic mass259.979645 Da
  • ChemSpider ID35492138

More details:

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

1779121-83-3 [RN]
7-Bromo-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 7-bromo-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxylate [ACD/IUPAC Name]
ethyl 7-bromo-2H,3H-pyrazolo[3,2-b][1,3]oxazole-6-carboxylate
Ethyl-7-brom-2,3-dihydropyrazolo[5,1-b][1,3]oxazol-6-carboxylat [German] [ACD/IUPAC Name]
Pyrazolo[5,1-b]oxazole-6-carboxylic acid, 7-bromo-2,3-dihydro-, ethyl ester [ACD/Index Name]
7-Bromo-2,3-dihydro-pyrazolo[5,1-b]oxazole-6-carboxylic acid ethyl ester
Ethyl 7-bromo-2,3-dihydropyrazolo[5,1-b]oxazole-6-carboxylate
MFCD26129336

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 358.1±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.4±3.0 kJ/mol
    Flash Point: 170.4±27.9 °C
    Index of Refraction: 1.660
    Molar Refractivity: 52.3±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.94
    ACD/LogD (pH 5.5): 1.75
    ACD/BCF (pH 5.5): 12.69
    ACD/KOC (pH 5.5): 214.51
    ACD/LogD (pH 7.4): 1.75
    ACD/BCF (pH 7.4): 12.69
    ACD/KOC (pH 7.4): 214.51
    Polar Surface Area: 53 Å2
    Polarizability: 20.7±0.5 10-24cm3
    Surface Tension: 55.8±7.0 dyne/cm
    Molar Volume: 141.8±7.0 cm3

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