ChemSpider 2D Image | 1-[3-Ethoxy-4-(pentyloxy)phenyl]-5,7-dimethyl-2-pentyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione | C31H39NO5

1-[3-Ethoxy-4-(pentyloxy)phenyl]-5,7-dimethyl-2-pentyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione

  • Molecular FormulaC31H39NO5
  • Average mass505.645 Da
  • Monoisotopic mass505.282837 Da
  • ChemSpider ID11983395

More details:

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

[1]Benzopyrano[2,3-c]pyrrole-3,9-dione, 1-[3-ethoxy-4-(pentyloxy)phenyl]-1,2-dihydro-5,7-dimethyl-2-pentyl- [ACD/Index Name]
1-[3-Ethoxy-4-(pentyloxy)phenyl]-5,7-dimethyl-2-pentyl-1,2-dihydrochromeno[2,3-c]pyrrol-3,9-dion [German] [ACD/IUPAC Name]
1-[3-Ethoxy-4-(pentyloxy)phenyl]-5,7-dimethyl-2-pentyl-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione [ACD/IUPAC Name]
1-[3-Éthoxy-4-(pentyloxy)phényl]-5,7-diméthyl-2-pentyl-1,2-dihydrochroméno[2,3-c]pyrrole-3,9-dione [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 662.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.5±3.0 kJ/mol
Flash Point: 354.7±31.5 °C
Index of Refraction: 1.584
Molar Refractivity: 144.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 7.85
ACD/LogD (pH 5.5): 7.27
ACD/BCF (pH 5.5): 198276.50
ACD/KOC (pH 5.5): 215457.98
ACD/LogD (pH 7.4): 7.27
ACD/BCF (pH 7.4): 198276.50
ACD/KOC (pH 7.4): 215457.98
Polar Surface Area: 65 Å2
Polarizability: 57.1±0.5 10-24cm3
Surface Tension: 50.2±5.0 dyne/cm
Molar Volume: 430.8±5.0 cm3

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