ChemSpider 2D Image | 1-[4-(Benzyloxy)-3-ethoxyphenyl]-6,7-dimethyl-2-(5-methyl-2-pyridinyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione | C34H30N2O5

1-[4-(Benzyloxy)-3-ethoxyphenyl]-6,7-dimethyl-2-(5-methyl-2-pyridinyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione

  • Molecular FormulaC34H30N2O5
  • Average mass546.612 Da
  • Monoisotopic mass546.215454 Da
  • ChemSpider ID3896462

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-(phenylmethoxy)phenyl]-1,2-dihydro-6,7-dimethyl-2-(5-methyl-2-pyridinyl)- [ACD/Index Name]
1-[4-(Benzyloxy)-3-ethoxyphenyl]-6,7-dimethyl-2-(5-methyl-2-pyridinyl)-1,2-dihydrochromeno[2,3-c]pyrrol-3,9-dion [German] [ACD/IUPAC Name]
1-[4-(Benzyloxy)-3-ethoxyphenyl]-6,7-dimethyl-2-(5-methyl-2-pyridinyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione [ACD/IUPAC Name]
1-[4-(Benzyloxy)-3-éthoxyphényl]-6,7-diméthyl-2-(5-méthyl-2-pyridinyl)-1,2-dihydrochroméno[2,3-c]pyrrole-3,9-dione [French] [ACD/IUPAC Name]
1-[4-(Benzyloxy)-3-ethoxyphenyl]-6,7-dimethyl-2-(5-methylpyridin-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione

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

Density: 1.3±0.1 g/cm3
Boiling Point: 723.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.7±3.0 kJ/mol
Flash Point: 391.5±32.9 °C
Index of Refraction: 1.674
Molar Refractivity: 154.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.83
ACD/LogD (pH 5.5): 5.47
ACD/BCF (pH 5.5): 8360.52
ACD/KOC (pH 5.5): 22003.15
ACD/LogD (pH 7.4): 5.49
ACD/BCF (pH 7.4): 8816.44
ACD/KOC (pH 7.4): 23203.04
Polar Surface Area: 78 Å2
Polarizability: 61.2±0.5 10-24cm3
Surface Tension: 65.1±5.0 dyne/cm
Molar Volume: 411.1±5.0 cm3

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