ChemSpider 2D Image | 6-(2-Hydroxy-4,6-dimethoxyphenyl)-6a-methyl-2,8-diphenyl-3a,4,6,6a,9a,10,10a,10b-octahydroisoindolo[5,6-e]isoindole-1,3,7,9(2H,8H)-tetrone | C35H32N2O7

6-(2-Hydroxy-4,6-dimethoxyphenyl)-6a-methyl-2,8-diphenyl-3a,4,6,6a,9a,10,10a,10b-octahydroisoindolo[5,6-e]isoindole-1,3,7,9(2H,8H)-tetrone

  • Molecular FormulaC35H32N2O7
  • Average mass592.638 Da
  • Monoisotopic mass592.220947 Da
  • ChemSpider ID3361152

More details:

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

6-(2-Hydroxy-4,6-dimethoxyphenyl)-6a-methyl-2,8-diphenyl-3a,4,6,6a,9a,10,10a,10b-octahydroisoindolo[5,6-e]isoindol-1,3,7,9(2H,8H)-tetron [German] [ACD/IUPAC Name]
6-(2-Hydroxy-4,6-dimethoxyphenyl)-6a-methyl-2,8-diphenyl-3a,4,6,6a,9a,10,10a,10b-octahydroisoindolo[5,6-e]isoindole-1,3,7,9(2H,8H)-tetrone [ACD/IUPAC Name]
6-(2-Hydroxy-4,6-diméthoxyphényl)-6a-méthyl-2,8-diphényl-3a,4,6,6a,9a,10,10a,10b-octahydroisoindolo[5,6-e]isoindole-1,3,7,9(2H,8H)-tétrone [French] [ACD/IUPAC Name]
Isoindolo[5,6-e]isoindole-1,3,7,9(2H,8H)-tetrone, 3a,4,6,6a,9a,10,10a,10b-octahydro-6-(2-hydroxy-4,6-dimethoxyphenyl)-6a-methyl-2,8-diphenyl- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 840.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 126.3±3.0 kJ/mol
Flash Point: 462.0±34.3 °C
Index of Refraction: 1.697
Molar Refractivity: 159.5±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 2.94
ACD/LogD (pH 5.5): 3.61
ACD/BCF (pH 5.5): 323.20
ACD/KOC (pH 5.5): 2176.96
ACD/LogD (pH 7.4): 3.59
ACD/BCF (pH 7.4): 315.69
ACD/KOC (pH 7.4): 2126.35
Polar Surface Area: 113 Å2
Polarizability: 63.2±0.5 10-24cm3
Surface Tension: 72.9±5.0 dyne/cm
Molar Volume: 414.1±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement