ChemSpider 2D Image | 4-(3,5-Dioxo-4-azatetracyclo[5.3.2.0~2,6~.0~8,10~]dodec-11-en-4-yl)phenyl 1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinecarboxylate | C30H28N2O6

4-(3,5-Dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl)phenyl 1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinecarboxylate

  • Molecular FormulaC30H28N2O6
  • Average mass512.553 Da
  • Monoisotopic mass512.194763 Da
  • ChemSpider ID12812585

More details:

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

1-(4-Éthoxyphényl)-5-oxo-3-pyrrolidinecarboxylate de 4-(3,5-dioxo-4-azatétracyclo[5.3.2.02,6.08,10]dodéc-11-én-4-yl)phényle [French] [ACD/IUPAC Name]
3-Pyrrolidinecarboxylic acid, 1-(4-ethoxyphenyl)-5-oxo-, 4-(3,3a,4,4a,5,5a,6,6a-octahydro-1,3-dioxo-4,6-ethenocycloprop[f]isoindol-2(1H)-yl)phenyl ester [ACD/Index Name]
4-(3,5-Dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl)phenyl 1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinecarboxylate [ACD/IUPAC Name]
4-(3,5-Dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl)phenyl 1-(4-ethoxyphenyl)-5-oxopyrrolidine-3-carboxylate
4-(3,5-Dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl)phenyl-1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
4-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)phenyl 1-(4-ethoxyphenyl)-5-oxopyrrolidine-3-carboxylate

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

Density: 1.4±0.1 g/cm3
Boiling Point: 815.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 118.5±3.0 kJ/mol
Flash Point: 447.0±34.3 °C
Index of Refraction: 1.647
Molar Refractivity: 135.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 2.37
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 57.81
ACD/KOC (pH 5.5): 635.11
ACD/LogD (pH 7.4): 2.62
ACD/BCF (pH 7.4): 57.81
ACD/KOC (pH 7.4): 635.11
Polar Surface Area: 93 Å2
Polarizability: 53.6±0.5 10-24cm3
Surface Tension: 59.8±3.0 dyne/cm
Molar Volume: 372.2±3.0 cm3

Click to predict properties on the Chemicalize site


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