ChemSpider 2D Image | (8S,9R,13S,14S,17S)-13-Ethyl-3-methoxy(9,11-~3~H_2_)-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-17-ol | C20H26T2O2

(8S,9R,13S,14S,17S)-13-Ethyl-3-methoxy(9,11-3H2)-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-17-ol

  • Molecular FormulaC20H26T2O2
  • Average mass304.451 Da
  • Monoisotopic mass304.225372 Da
  • ChemSpider ID8533149
  • defined stereocentres - 5 of 5 defined stereocentres

    Non-standard isotope - Non-standard isotope


More details:






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

(8S,9R,13S,14S,17S)-13-Ethyl-3-methoxy(9,11-3H2)-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-17-ol [ACD/IUPAC Name]
(8S,9R,13S,14S,17S)-13-Ethyl-3-methoxy(9,11-3H2)-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-17-ol [German] [ACD/IUPAC Name]
(8S,9R,13S,14S,17S)-13-Éthyl-3-méthoxy(9,11-3H2)-7,8,9,11,12,13,14,15,16,17-décahydro-6H-cyclopenta[a]phénanthrén-17-ol [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
Boiling Point: 441.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.6±3.0 kJ/mol
Flash Point: 192.0±23.0 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.31
ACD/LogD (pH 5.5): 4.37
ACD/BCF (pH 5.5): 1234.08
ACD/KOC (pH 5.5): 5680.45
ACD/LogD (pH 7.4): 4.37
ACD/BCF (pH 7.4): 1234.08
ACD/KOC (pH 7.4): 5680.45
Polar Surface Area: 29 Å2
Polarizability:
Surface Tension:
Molar Volume:

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