ChemSpider 2D Image | Ethyl 1-[5-(methylamino)-2-pyridinyl]-1H-pyrazole-4-carboxylate | C12H14N4O2

Ethyl 1-[5-(methylamino)-2-pyridinyl]-1H-pyrazole-4-carboxylate

  • Molecular FormulaC12H14N4O2
  • Average mass246.265 Da
  • Monoisotopic mass246.111679 Da
  • ChemSpider ID30507857

More details:

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

1-[5-(Méthylamino)-2-pyridinyl]-1H-pyrazole-4-carboxylate d'éthyle [French] [ACD/IUPAC Name]
1624261-04-6 [RN]
1H-Pyrazole-4-carboxylic acid, 1-[5-(methylamino)-2-pyridinyl]-, ethyl ester [ACD/Index Name]
Ethyl 1-[5-(methylamino)-2-pyridinyl]-1H-pyrazole-4-carboxylate [ACD/IUPAC Name]
ETHYL 1-[5-(METHYLAMINO)PYRIDIN-2-YL]-1H-PYRAZOLE-4-CARBOXYLATE
Ethyl-1-[5-(methylamino)-2-pyridinyl]-1H-pyrazol-4-carboxylat [German] [ACD/IUPAC Name]
Ethyl 1-(5-(methylamino)pyridin-2-yl)-1H-pyrazole-4-carboxylate
ETHYL 1-[5-(METHYLAMINO)PYRIDIN-2-YL]PYRAZOLE-4-CARBOXYLATE
ethyl1-(5-(methylamino)pyridin-2-yl)-1H-pyrazole-4-carboxylate
MFCD26403991 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 412.0±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.5±3.0 kJ/mol
    Flash Point: 203.0±25.9 °C
    Index of Refraction: 1.608
    Molar Refractivity: 67.7±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.46
    ACD/LogD (pH 5.5): 1.52
    ACD/BCF (pH 5.5): 8.40
    ACD/KOC (pH 5.5): 159.71
    ACD/LogD (pH 7.4): 1.52
    ACD/BCF (pH 7.4): 8.41
    ACD/KOC (pH 7.4): 159.78
    Polar Surface Area: 69 Å2
    Polarizability: 26.9±0.5 10-24cm3
    Surface Tension: 46.5±7.0 dyne/cm
    Molar Volume: 195.8±7.0 cm3

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