ChemSpider 2D Image | 1-Ethyl 7-(2-methyl-2-propanyl) 5,6-dihydroimidazo[1,5-a]pyrazine-1,7(8H)-dicarboxylate | C14H21N3O4

1-Ethyl 7-(2-methyl-2-propanyl) 5,6-dihydroimidazo[1,5-a]pyrazine-1,7(8H)-dicarboxylate

  • Molecular FormulaC14H21N3O4
  • Average mass295.334 Da
  • Monoisotopic mass295.153198 Da
  • ChemSpider ID58543349

More details:

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

1416447-72-7 [RN]
1-Ethyl 7-(2-methyl-2-propanyl) 5,6-dihydroimidazo[1,5-a]pyrazine-1,7(8H)-dicarboxylate [ACD/IUPAC Name]
1-Ethyl-7-(2-methyl-2-propanyl)-5,6-dihydroimidazo[1,5-a]pyrazin-1,7(8H)-dicarboxylat [German] [ACD/IUPAC Name]
5,6-Dihydroimidazo[1,5-a]pyrazine-1,7(8H)-dicarboxylate de 1-éthyle et de 7-(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
Imidazo[1,5-a]pyrazine-1,7(8H)-dicarboxylic acid, 5,6-dihydro-, 7-(1,1-dimethylethyl) 1-ethyl ester [ACD/Index Name]
7-tert-Butyl 1-ethyl 5,6-dihydroimidazo[1,5-a]pyrazine-1,7(8H)-dicarboxylate
7-tert-butyl 1-ethyl 5H,6H,7H,8H-imidazo[1,5-a]pyrazine-1,7-dicarboxylate
7-tert-Butyl1-ethyl5,6-dihydroimidazo[1,5-a]pyrazine-1,7(8H)-dicarboxylate
MFCD23131246

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 479.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.4±3.0 kJ/mol
    Flash Point: 243.8±28.7 °C
    Index of Refraction: 1.566
    Molar Refractivity: 77.2±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.66
    ACD/LogD (pH 5.5): 2.16
    ACD/BCF (pH 5.5): 25.72
    ACD/KOC (pH 5.5): 355.36
    ACD/LogD (pH 7.4): 2.16
    ACD/BCF (pH 7.4): 25.79
    ACD/KOC (pH 7.4): 356.37
    Polar Surface Area: 74 Å2
    Polarizability: 30.6±0.5 10-24cm3
    Surface Tension: 43.4±7.0 dyne/cm
    Molar Volume: 236.7±7.0 cm3

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