ChemSpider 2D Image | (8S,9S,10R,13R,14S)-13-Ethyl-11-methylene-1,2,3,6,7,8,9,10,11,12,13,14,15,16-tetradecahydro-17H-cyclopenta[a]phenanthren-17-one | C20H28O

(8S,9S,10R,13R,14S)-13-Ethyl-11-methylene-1,2,3,6,7,8,9,10,11,12,13,14,15,16-tetradecahydro-17H-cyclopenta[a]phenanthren-17-one

  • Molecular FormulaC20H28O
  • Average mass284.436 Da
  • Monoisotopic mass284.214020 Da
  • ChemSpider ID32792696

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(8S,9S,10R,13R,14S)-13-Ethyl-11-methylen-1,2,3,6,7,8,9,10,11,12,13,14,15,16-tetradecahydro-17H-cyclopenta[a]phenanthren-17-on [German] [ACD/IUPAC Name]
(8S,9S,10R,13R,14S)-13-Ethyl-11-methylene-1,2,3,6,7,8,9,10,11,12,13,14,15,16-tetradecahydro-17H-cyclopenta[a]phenanthren-17-one [ACD/IUPAC Name]
(8S,9S,10R,13R,14S)-13-Éthyl-11-méthylène-1,2,3,6,7,8,9,10,11,12,13,14,15,16-tétradécahydro-17H-cyclopenta[a]phénanthrén-17-one [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 412.5±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.5±3.0 kJ/mol
Flash Point: 177.9±23.4 °C
Index of Refraction: 1.547
Molar Refractivity: 85.7±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 5.65
ACD/LogD (pH 5.5): 4.90
ACD/BCF (pH 5.5): 3107.73
ACD/KOC (pH 5.5): 11002.35
ACD/LogD (pH 7.4): 4.90
ACD/BCF (pH 7.4): 3107.73
ACD/KOC (pH 7.4): 11002.35
Polar Surface Area: 17 Å2
Polarizability: 34.0±0.5 10-24cm3
Surface Tension: 38.9±5.0 dyne/cm
Molar Volume: 270.5±5.0 cm3

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