ChemSpider 2D Image | 1-(9-Hydroxy-6-methoxy-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 | C35H32O6

1-(9-Hydroxy-6-methoxy-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 FormulaC35H32O6
  • Average mass548.625 Da
  • Monoisotopic mass548.219910 Da
  • ChemSpider ID28641316

More details:

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

1-(9-Hydroxy-6-méthoxy-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-(9-Hydroxy-6-methoxy-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-(9-Hydroxy-6-methoxy-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-9-hydroxy-6-methoxy-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

Density: 1.3±0.1 g/cm3
Boiling Point: 752.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.5±3.0 kJ/mol
Flash Point: 242.8±26.4 °C
Index of Refraction: 1.676
Molar Refractivity: 155.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 7.11
ACD/LogD (pH 5.5): 6.35
ACD/BCF (pH 5.5): 39328.98
ACD/KOC (pH 5.5): 67678.70
ACD/LogD (pH 7.4): 6.34
ACD/BCF (pH 7.4): 38670.39
ACD/KOC (pH 7.4): 66545.35
Polar Surface Area: 90 Å2
Polarizability: 61.5±0.5 10-24cm3
Surface Tension: 62.1±5.0 dyne/cm
Molar Volume: 411.9±5.0 cm3

Click to predict properties on the Chemicalize site


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