ChemSpider 2D Image | Ethyl 4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-2-oxo-3-pyrrolidinecarboxylate | C16H19NO7

Ethyl 4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-2-oxo-3-pyrrolidinecarboxylate

  • Molecular FormulaC16H19NO7
  • Average mass337.325 Da
  • Monoisotopic mass337.116150 Da
  • ChemSpider ID28636784

More details:

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

3-Pyrrolidinecarboxylic acid, 4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-2-oxo-, ethyl ester [ACD/Index Name]
4-(6,7-Diméthoxy-1,3-benzodioxol-5-yl)-2-oxo-3-pyrrolidinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-2-oxo-3-pyrrolidinecarboxylate [ACD/IUPAC Name]
Ethyl-4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-2-oxo-3-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
4-(6,7-Dimethoxy-benzo[1,3]dioxol-5-yl)-2-oxo-pyrrolidine-3-carboxylic acid ethyl ester
ethyl 4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-2-oxopyrrolidine-3-carboxylate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 483.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.9±3.0 kJ/mol
Flash Point: 246.2±28.7 °C
Index of Refraction: 1.542
Molar Refractivity: 81.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.56
ACD/LogD (pH 5.5): 0.91
ACD/BCF (pH 5.5): 2.88
ACD/KOC (pH 5.5): 74.23
ACD/LogD (pH 7.4): 0.91
ACD/BCF (pH 7.4): 2.88
ACD/KOC (pH 7.4): 74.22
Polar Surface Area: 92 Å2
Polarizability: 32.3±0.5 10-24cm3
Surface Tension: 46.2±3.0 dyne/cm
Molar Volume: 258.7±3.0 cm3

Click to predict properties on the Chemicalize site


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