ChemSpider 2D Image | (5beta,8alpha,9xi,10alpha,13alpha,14xi,17alpha)-17-Hydroxy-17-methylandrost-1-en-3-one | C20H30O2

(5β,8α,9ξ,10α,13α,14ξ,17α)-17-Hydroxy-17-methylandrost-1-en-3-one

  • Molecular FormulaC20H30O2
  • Average mass302.451 Da
  • Monoisotopic mass302.224579 Da
  • ChemSpider ID113598256

  • defined stereocentres - 5 of 7 defined stereocentres

More details:

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

(5β,8α,9ξ,10α,13α,14ξ,17α)-17-Hydroxy-17-methylandrost-1-en-3-on [German] [ACD/IUPAC Name]
(5β,8α,9ξ,10α,13α,14ξ,17α)-17-Hydroxy-17-methylandrost-1-en-3-one [ACD/IUPAC Name]
(5β,8α,9ξ,10α,13α,14ξ,17α)-17-Hydroxy-17-méthylandrost-1-én-3-one [French] [ACD/IUPAC Name]
Androst-1-en-3-one, 17-hydroxy-17-methyl-, (5β,8α,9ξ,10α,13α,14ξ,17α)- [ACD/Index 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: 422.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.2±6.0 kJ/mol
Flash Point: 180.4±21.3 °C
Index of Refraction: 1.541
Molar Refractivity: 87.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.98
ACD/LogD (pH 5.5): 3.51
ACD/BCF (pH 5.5): 272.60
ACD/KOC (pH 5.5): 1927.31
ACD/LogD (pH 7.4): 3.51
ACD/BCF (pH 7.4): 272.60
ACD/KOC (pH 7.4): 1927.31
Polar Surface Area: 37 Å2
Polarizability: 34.8±0.5 10-24cm3
Surface Tension: 40.3±3.0 dyne/cm
Molar Volume: 279.3±3.0 cm3

Click to predict properties on the Chemicalize site


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