ChemSpider 2D Image | 6,8-Dihydroxy-11,12a-dimethyl-3,4,4a,4b,5,6,10b,11,12,12a-decahydro-1(2H)-chrysenone | C20H26O3

6,8-Dihydroxy-11,12a-dimethyl-3,4,4a,4b,5,6,10b,11,12,12a-decahydro-1(2H)-chrysenone

  • Molecular FormulaC20H26O3
  • Average mass314.419 Da
  • Monoisotopic mass314.188202 Da
  • ChemSpider ID28689038

More details:

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

1(2H)-Chrysenone, 3,4,4a,4b,5,6,10b,11,12,12a-decahydro-6,8-dihydroxy-11,12a-dimethyl- [ACD/Index Name]
6,8-Dihydroxy-11,12a-dimethyl-3,4,4a,4b,5,6,10b,11,12,12a-decahydro-1(2H)-chrysenon [German] [ACD/IUPAC Name]
6,8-Dihydroxy-11,12a-dimethyl-3,4,4a,4b,5,6,10b,11,12,12a-decahydro-1(2H)-chrysenone [ACD/IUPAC Name]
6,8-Dihydroxy-11,12a-diméthyl-3,4,4a,4b,5,6,10b,11,12,12a-décahydro-1(2H)-chrysénone [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 504.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.5±3.0 kJ/mol
Flash Point: 273.1±26.6 °C
Index of Refraction: 1.581
Molar Refractivity: 89.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.89
ACD/LogD (pH 5.5): 3.03
ACD/BCF (pH 5.5): 117.24
ACD/KOC (pH 5.5): 1053.52
ACD/LogD (pH 7.4): 3.02
ACD/BCF (pH 7.4): 117.00
ACD/KOC (pH 7.4): 1051.43
Polar Surface Area: 58 Å2
Polarizability: 35.3±0.5 10-24cm3
Surface Tension: 46.8±3.0 dyne/cm
Molar Volume: 266.9±3.0 cm3

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