ChemSpider 2D Image | 2-(1,3-Benzodioxol-5-ylmethyl)-1-(4-isobutoxy-3-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione | C30H27NO7

2-(1,3-Benzodioxol-5-ylmethyl)-1-(4-isobutoxy-3-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione

  • Molecular FormulaC30H27NO7
  • Average mass513.538 Da
  • Monoisotopic mass513.178772 Da
  • ChemSpider ID11900812

More details:

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

[1]Benzopyrano[2,3-c]pyrrole-3,9-dione, 2-(1,3-benzodioxol-5-ylmethyl)-1,2-dihydro-1-[3-methoxy-4-(2-methylpropoxy)phenyl]- [ACD/Index Name]
2-(1,3-Benzodioxol-5-ylmethyl)-1-(4-isobutoxy-3-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrol-3,9-dion [German] [ACD/IUPAC Name]
2-(1,3-Benzodioxol-5-ylmethyl)-1-(4-isobutoxy-3-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione [ACD/IUPAC Name]
2-(1,3-Benzodioxol-5-ylméthyl)-1-(4-isobutoxy-3-méthoxyphényl)-1,2-dihydrochroméno[2,3-c]pyrrole-3,9-dione [French] [ACD/IUPAC Name]
2-(1,3-benzodioxol-5-ylmethyl)-1-[3-methoxy-4-(2-methylpropoxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
2-(1,3-benzodioxol-5-ylmethyl)-1-[3-methoxy-4-(2-methylpropoxy)phenyl]-1H-chromeno[2,3-c]pyrrole-3,9-dione
2-(2H-benzo[3,4-d]1,3-dioxolan-5-ylmethyl)-1-[3-methoxy-4-(2-methylpropoxy)phenyl]chromeno[2,3-c]3-pyrroline-3,9-dione
2-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[3-methoxy-4-(2-methylpropoxy)phenyl]-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione

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

Density: 1.4±0.1 g/cm3
Boiling Point: 691.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.4±3.0 kJ/mol
Flash Point: 372.3±31.5 °C
Index of Refraction: 1.667
Molar Refractivity: 137.8±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.31
ACD/LogD (pH 5.5): 4.29
ACD/BCF (pH 5.5): 1078.24
ACD/KOC (pH 5.5): 5157.24
ACD/LogD (pH 7.4): 4.29
ACD/BCF (pH 7.4): 1078.24
ACD/KOC (pH 7.4): 5157.24
Polar Surface Area: 84 Å2
Polarizability: 54.6±0.5 10-24cm3
Surface Tension: 64.5±5.0 dyne/cm
Molar Volume: 370.2±5.0 cm3

Click to predict properties on the Chemicalize site


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