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ChemSpider 2D Image | 6a-Ethyl 1-(2-methyl-2-propanyl) hexahydropyrrolo[3,2-b]pyrrole-1,6a-dicarboxylate | C14H24N2O4

6a-Ethyl 1-(2-methyl-2-propanyl) hexahydropyrrolo[3,2-b]pyrrole-1,6a-dicarboxylate

  • Molecular FormulaC14H24N2O4
  • Average mass284.351 Da
  • Monoisotopic mass284.173615 Da
  • ChemSpider ID34066408

More details:

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

6a-Ethyl 1-(2-methyl-2-propanyl) hexahydropyrrolo[3,2-b]pyrrole-1,6a-dicarboxylate [ACD/IUPAC Name]
6a-Ethyl-1-(2-methyl-2-propanyl)-hexahydropyrrolo[3,2-b]pyrrol-1,6a-dicarboxylat [German] [ACD/IUPAC Name]
Hexahydropyrrolo[3,2-b]pyrrole-1,6a-dicarboxylate de 6a-éthyle et de 1-(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
Pyrrolo[3,2-b]pyrrole-1,6a-dicarboxylic acid, hexahydro-, 1-(1,1-dimethylethyl) 6a-ethyl ester [ACD/Index Name]
1-(tert-butyl) 6a-ethyl hexahydropyrrolo[3,2-b]pyrrole-1,6a-dicarboxylate
1250994-55-8 [RN]
1-tert-Butyl 6a-ethyl hexahydropyrrolo[3,2-b]pyrrole-1,6a(2H)-dicarboxylate
1-tert-butyl 6a-ethyl octahydropyrrolo[3,2-b]pyrrole-1,6a-dicarboxylate
o4-tert-butyl o3a-ethyl 1,2,3,5,6,6a-hexahydro-pyrrolo[3,2-b]pyrrole-3a,4-dicarboxylate

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

    Density: 1.2±0.1 g/cm3
    Boiling Point: 363.3±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.9±3.0 kJ/mol
    Flash Point: 173.5±25.1 °C
    Index of Refraction: 1.505
    Molar Refractivity: 72.9±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.62
    ACD/LogD (pH 5.5): -1.07
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.05
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.46
    Polar Surface Area: 68 Å2
    Polarizability: 28.9±0.5 10-24cm3
    Surface Tension: 42.4±3.0 dyne/cm
    Molar Volume: 246.1±3.0 cm3

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