ChemSpider 2D Image | Diethyl 1,5-dimethyl-3-phenyl-1H-pyrrole-2,4-dicarboxylate | C18H21NO4

Diethyl 1,5-dimethyl-3-phenyl-1H-pyrrole-2,4-dicarboxylate

  • Molecular FormulaC18H21NO4
  • Average mass315.364 Da
  • Monoisotopic mass315.147064 Da
  • ChemSpider ID26232643

More details:

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

1,5-Diméthyl-3-phényl-1H-pyrrole-2,4-dicarboxylate de diéthyle [French] [ACD/IUPAC Name]
161560-98-1 [RN]
1H-Pyrrole-2,4-dicarboxylic acid, 1,5-dimethyl-3-phenyl-, diethyl ester [ACD/Index Name]
Diethyl 1,5-dimethyl-3-phenyl-1H-pyrrole-2,4-dicarboxylate [ACD/IUPAC Name]
Diethyl-1,5-dimethyl-3-phenyl-1H-pyrrol-2,4-dicarboxylat [German] [ACD/IUPAC Name]
[161560-98-1] [RN]
1H-Pyrrole-2,4-dicarboxylic acid, 1,5-dimethyl-3-phenyl-, 2,4-diethyl ester
2,4-diethyl 1,5-dimethyl-3-phenyl-1H-pyrrole-2,4-dicarboxylate
2,4-diethyl 1,5-dimethyl-3-phenylpyrrole-2,4-dicarboxylate
diethyl 1,5-dimethyl-3-phenyl-pyrrole-2,4-dicarboxylate
More...

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

CCRIS 4693 [DBID]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 466.3±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 72.8±3.0 kJ/mol
    Flash Point: 235.8±28.7 °C
    Index of Refraction: 1.541
    Molar Refractivity: 88.1±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 4.73
    ACD/LogD (pH 5.5): 4.39
    ACD/BCF (pH 5.5): 1269.43
    ACD/KOC (pH 5.5): 5796.46
    ACD/LogD (pH 7.4): 4.39
    ACD/BCF (pH 7.4): 1269.43
    ACD/KOC (pH 7.4): 5796.46
    Polar Surface Area: 58 Å2
    Polarizability: 34.9±0.5 10-24cm3
    Surface Tension: 37.5±7.0 dyne/cm
    Molar Volume: 280.2±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement