ChemSpider 2D Image | Ethyl 5-(methoxymethyl)-1H-pyrazole-3-carboxylate | C8H12N2O3

Ethyl 5-(methoxymethyl)-1H-pyrazole-3-carboxylate

  • Molecular FormulaC8H12N2O3
  • Average mass184.193 Da
  • Monoisotopic mass184.084793 Da
  • ChemSpider ID29784450

More details:

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

1297546-22-5 [RN]
1H-Pyrazole-3-carboxylic acid, 5-(methoxymethyl)-, ethyl ester [ACD/Index Name]
5-(Méthoxyméthyl)-1H-pyrazole-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 5-(methoxymethyl)-1H-pyrazole-3-carboxylate [ACD/IUPAC Name]
Ethyl-5-(methoxymethyl)-1H-pyrazol-3-carboxylat [German] [ACD/IUPAC Name]
Chemistry 9059
MFCD23105878

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 329.4±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.2±3.0 kJ/mol
    Flash Point: 153.0±25.1 °C
    Index of Refraction: 1.513
    Molar Refractivity: 46.5±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 0.37
    ACD/LogD (pH 5.5): 1.01
    ACD/BCF (pH 5.5): 3.45
    ACD/KOC (pH 5.5): 84.38
    ACD/LogD (pH 7.4): 1.01
    ACD/BCF (pH 7.4): 3.44
    ACD/KOC (pH 7.4): 84.29
    Polar Surface Area: 64 Å2
    Polarizability: 18.4±0.5 10-24cm3
    Surface Tension: 45.7±3.0 dyne/cm
    Molar Volume: 154.6±3.0 cm3

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