ChemSpider 2D Image | Ethyl 5-oxo-4,5-dihydropyrazolo[1,5-a]pyrimidine-3-carboxylate | C9H9N3O3

Ethyl 5-oxo-4,5-dihydropyrazolo[1,5-a]pyrimidine-3-carboxylate

  • Molecular FormulaC9H9N3O3
  • Average mass207.186 Da
  • Monoisotopic mass207.064392 Da
  • ChemSpider ID24598170

More details:

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

5-Oxo-4,5-dihydropyrazolo[1,5-a]pyrimidine-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
926663-00-5 [RN]
Ethyl 5-oxo-4,5-dihydropyrazolo[1,5-a]pyrimidine-3-carboxylate [ACD/IUPAC Name]
Ethyl-5-oxo-4,5-dihydropyrazolo[1,5-a]pyrimidin-3-carboxylat [German] [ACD/IUPAC Name]
Pyrazolo[1,5-a]pyrimidine-3-carboxylic acid, 4,5-dihydro-5-oxo-, ethyl ester [ACD/Index Name]
[926663-00-5] [RN]
1026456-01-8 [RN]
5-hydroxypyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester
5-oxo-4,5-dihydro-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester
5-oxo-4,5-dihydro-pyrazolo1,5-apyrimidine-3-carboxylic acid ethyl ester
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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: 1.5±0.1 g/cm3
    Boiling Point: 339.6±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 58.3±3.0 kJ/mol
    Flash Point: 159.2±27.9 °C
    Index of Refraction: 1.658
    Molar Refractivity: 51.9±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.98
    ACD/LogD (pH 5.5): 1.38
    ACD/BCF (pH 5.5): 6.54
    ACD/KOC (pH 5.5): 133.45
    ACD/LogD (pH 7.4): 1.38
    ACD/BCF (pH 7.4): 6.53
    ACD/KOC (pH 7.4): 133.40
    Polar Surface Area: 73 Å2
    Polarizability: 20.6±0.5 10-24cm3
    Surface Tension: 58.1±7.0 dyne/cm
    Molar Volume: 140.9±7.0 cm3

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