ChemSpider 2D Image | Diethyl 1H-indole-2,3-dicarboxylate | C14H15NO4

Diethyl 1H-indole-2,3-dicarboxylate

  • Molecular FormulaC14H15NO4
  • Average mass261.273 Da
  • Monoisotopic mass261.100098 Da
  • ChemSpider ID24609053

More details:

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

128942-88-1 [RN]
1H-Indole-2,3-dicarboxylate de diéthyle [French] [ACD/IUPAC Name]
1H-Indole-2,3-dicarboxylic acid, diethyl ester [ACD/Index Name]
Diethyl 1H-indole-2,3-dicarboxylate [ACD/IUPAC Name]
Diethyl-1H-indol-2,3-dicarboxylat [German] [ACD/IUPAC Name]
[128942-88-1] [RN]
1H-Indole-2,3-dicarboxylicacid, 2,3-diethyl ester
1H-Indole-2,3-dicarboxylicacid,2,3-diethyl ester
2,3-DIETHYL 1H-INDOLE-2,3-DICARBOXYLATE
AGN-PC-003SNP
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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: 390.8±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.0±3.0 kJ/mol
    Flash Point: 190.1±22.3 °C
    Index of Refraction: 1.593
    Molar Refractivity: 71.3±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 3.49
    ACD/LogD (pH 5.5): 3.27
    ACD/BCF (pH 5.5): 180.12
    ACD/KOC (pH 5.5): 1432.65
    ACD/LogD (pH 7.4): 3.27
    ACD/BCF (pH 7.4): 180.12
    ACD/KOC (pH 7.4): 1432.65
    Polar Surface Area: 68 Å2
    Polarizability: 28.3±0.5 10-24cm3
    Surface Tension: 49.9±3.0 dyne/cm
    Molar Volume: 210.7±3.0 cm3

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