ChemSpider 2D Image | (5alpha,10xi,13xi)-Androstane-3,17-dione | C19H28O2

(5α,10ξ,13ξ)-Androstane-3,17-dione

  • Molecular FormulaC19H28O2
  • Average mass288.424 Da
  • Monoisotopic mass288.208923 Da
  • ChemSpider ID31106621
  • defined stereocentres - 4 of 6 defined stereocentres


More details:






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

(5α,10ξ,13ξ)-Androstan-3,17-dion [German] [ACD/IUPAC Name]
(5α,10ξ,13ξ)-Androstane-3,17-dione [ACD/IUPAC Name]
(5α,10ξ,13ξ)-Androstane-3,17-dione [French] [ACD/IUPAC Name]
Androstane-3,17-dione, (5α,10ξ,13ξ)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 411.2±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.4±3.0 kJ/mol
Flash Point: 153.9±23.8 °C
Index of Refraction: 1.526
Molar Refractivity: 82.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.17
ACD/LogD (pH 5.5): 3.38
ACD/BCF (pH 5.5): 218.90
ACD/KOC (pH 5.5): 1647.22
ACD/LogD (pH 7.4): 3.38
ACD/BCF (pH 7.4): 218.90
ACD/KOC (pH 7.4): 1647.22
Polar Surface Area: 34 Å2
Polarizability: 32.5±0.5 10-24cm3
Surface Tension: 39.1±3.0 dyne/cm
Molar Volume: 267.1±3.0 cm3

Click to predict properties on the Chemicalize site






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