ChemSpider 2D Image | 2-tert-butyl 6-methyl 1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-2,6-dicarboxylate | C14H20N2O4

2-tert-butyl 6-methyl 1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-2,6-dicarboxylate

  • Molecular FormulaC14H20N2O4
  • Average mass280.320 Da
  • Monoisotopic mass280.142303 Da
  • ChemSpider ID27471119

More details:






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

1363383-12-3 [RN]
2-tert-butyl 6-methyl 1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-2,6-dicarboxylate
3,4-Dihydropyrrolo[1,2-a]pyrazine-2,6(1H)-dicarboxylate de 6-méthyle et de 2-(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
6-Methyl 2-(2-methyl-2-propanyl) 3,4-dihydropyrrolo[1,2-a]pyrazine-2,6(1H)-dicarboxylate [ACD/IUPAC Name]
6-Methyl-2-(2-methyl-2-propanyl)-3,4-dihydropyrrolo[1,2-a]pyrazin-2,6(1H)-dicarboxylat [German] [ACD/IUPAC Name]
Pyrrolo[1,2-a]pyrazine-2,6(1H)-dicarboxylic acid, 3,4-dihydro-, 2-(1,1-dimethylethyl) 6-methyl ester [ACD/Index Name]
1174068-79-1 [RN]
2-tert-Butyl 6-methyl 1H,3H,4H-pyrrolo[1,2-a]pyrazine-2,6-dicarboxylate
2-tert-Butyl 6-methyl 3,4-dihydropyrrolo[1,2-a]pyrazine-2,6(1H)-dicarboxylate
3,4-Dihydro-1H-pyrrolo[1,2-a]pyrazine-2,6-dicarboxylic acid 2-tert-butyl ester 6-methyl ester
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 415.9±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.9±3.0 kJ/mol
    Flash Point: 205.3±28.7 °C
    Index of Refraction: 1.552
    Molar Refractivity: 74.2±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.21
    ACD/LogD (pH 5.5): 3.09
    ACD/BCF (pH 5.5): 132.37
    ACD/KOC (pH 5.5): 1149.19
    ACD/LogD (pH 7.4): 3.09
    ACD/BCF (pH 7.4): 132.37
    ACD/KOC (pH 7.4): 1149.19
    Polar Surface Area: 61 Å2
    Polarizability: 29.4±0.5 10-24cm3
    Surface Tension: 41.2±7.0 dyne/cm
    Molar Volume: 232.0±7.0 cm3

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