ChemSpider 2D Image | Methyl 5-diethoxymethylimidazole-4-carboxylate | C10H16N2O4

Methyl 5-diethoxymethylimidazole-4-carboxylate

  • Molecular FormulaC10H16N2O4
  • Average mass228.245 Da
  • Monoisotopic mass228.111008 Da
  • ChemSpider ID21613303

More details:

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

1H-Imidazole-4-carboxylic acid, 5-(diethoxymethyl)-, methyl ester [ACD/Index Name]
4-(Diéthoxyméthyl)-1H-imidazole-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
85109-99-5 [RN]
Methyl 4-(diethoxymethyl)-1H-imidazole-5-carboxylate [ACD/IUPAC Name]
Methyl 5-(diethoxymethyl)-1H-imidazole-4-carboxylate
Methyl 5-diethoxymethylimidazole-4-carboxylate
Methyl-4-(diethoxymethyl)-1H-imidazol-5-carboxylat [German] [ACD/IUPAC Name]
methyl 5-(diethoxymethyl)-1h-imidazole-4-carboxylate(wx191894)
METHYL5-DIETHOXYMETHYLIMIDAZOLE-4-CARBOXYLATE
MFCD09033058 [MDL number]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 376.7±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 62.4±3.0 kJ/mol
    Flash Point: 181.6±27.9 °C
    Index of Refraction: 1.502
    Molar Refractivity: 57.5±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 1.14
    ACD/LogD (pH 5.5): 0.99
    ACD/BCF (pH 5.5): 3.35
    ACD/KOC (pH 5.5): 82.58
    ACD/LogD (pH 7.4): 1.00
    ACD/BCF (pH 7.4): 3.36
    ACD/KOC (pH 7.4): 82.89
    Polar Surface Area: 73 Å2
    Polarizability: 22.8±0.5 10-24cm3
    Surface Tension: 43.4±3.0 dyne/cm
    Molar Volume: 194.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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