ChemSpider 2D Image | (2beta,3beta,5beta,8alpha,9beta,10alpha,13alpha,14beta,17alpha)-2,3-Epithioandrostan-17-ol | C19H30OS

(2β,3β,5β,8α,9β,10α,13α,14β,17α)-2,3-Epithioandrostan-17-ol

  • Molecular FormulaC19H30OS
  • Average mass306.506 Da
  • Monoisotopic mass306.201721 Da
  • ChemSpider ID113602056

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(2β,3β,5β,8α,9β,10α,13α,14β,17α)-2,3-Epithioandrostan-17-ol [ACD/IUPAC Name]
(2β,3β,5β,8α,9β,10α,13α,14β,17α)-2,3-Épithioandrostan-17-ol [French] [ACD/IUPAC Name]
Androstan-17-ol, 2,3-epithio-, (2β,3β,5β,8α,9β,10α,13α,14β,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: 424.4±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.4±6.0 kJ/mol
Flash Point: 206.1±25.5 °C
Index of Refraction: 1.580
Molar Refractivity: 89.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.74
ACD/LogD (pH 5.5): 4.26
ACD/BCF (pH 5.5): 1015.22
ACD/KOC (pH 5.5): 4939.65
ACD/LogD (pH 7.4): 4.26
ACD/BCF (pH 7.4): 1015.22
ACD/KOC (pH 7.4): 4939.65
Polar Surface Area: 46 Å2
Polarizability: 35.5±0.5 10-24cm3
Surface Tension: 46.3±3.0 dyne/cm
Molar Volume: 269.4±3.0 cm3

Click to predict properties on the Chemicalize site


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