ChemSpider 2D Image | 1-(6,9-Dihydroxy-1,1,7-trimethyl-2-oxo-1,2-dihydro-3-phenanthrenyl)-8-methoxy-3,3,7-trimethyl-2H-cyclopenta[a]naphthalene-2,5(3H)-dione | C34H30O6

1-(6,9-Dihydroxy-1,1,7-trimethyl-2-oxo-1,2-dihydro-3-phenanthrenyl)-8-methoxy-3,3,7-trimethyl-2H-cyclopenta[a]naphthalene-2,5(3H)-dione

  • Molecular FormulaC34H30O6
  • Average mass534.598 Da
  • Monoisotopic mass534.204224 Da
  • ChemSpider ID28639825

More details:

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

1-(6,9-Dihydroxy-1,1,7-triméthyl-2-oxo-1,2-dihydro-3-phénanthrényl)-8-méthoxy-3,3,7-triméthyl-2H-cyclopenta[a]naphtalène-2,5(3H)-dione [French] [ACD/IUPAC Name]
1-(6,9-Dihydroxy-1,1,7-trimethyl-2-oxo-1,2-dihydro-3-phenanthrenyl)-8-methoxy-3,3,7-trimethyl-2H-cyclopenta[a]naphthalene-2,5(3H)-dione [ACD/IUPAC Name]
1-(6,9-Dihydroxy-1,1,7-trimethyl-2-oxo-1,2-dihydro-3-phenanthrenyl)-8-methoxy-3,3,7-trimethyl-2H-cyclopenta[a]naphthalin-2,5(3H)-dion [German] [ACD/IUPAC Name]
2H-Benz[e]indene-2,5(3H)-dione, 1-(1,2-dihydro-6,9-dihydroxy-1,1,7-trimethyl-2-oxo-3-phenanthrenyl)-8-methoxy-3,3,7-trimethyl- [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: 769.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 116.0±3.0 kJ/mol
Flash Point: 251.6±26.4 °C
Index of Refraction: 1.703
Molar Refractivity: 150.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: 6.66
ACD/LogD (pH 5.5): 5.86
ACD/BCF (pH 5.5): 16643.07
ACD/KOC (pH 5.5): 36567.85
ACD/LogD (pH 7.4): 5.84
ACD/BCF (pH 7.4): 16163.95
ACD/KOC (pH 7.4): 35515.14
Polar Surface Area: 101 Å2
Polarizability: 59.5±0.5 10-24cm3
Surface Tension: 68.3±5.0 dyne/cm
Molar Volume: 387.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement