ChemSpider 2D Image | (9xi,14xi,17beta)-3-Oxoandrost-4-en-17-yl hydrogen sulfate | C19H28O5S

(9ξ,14ξ,17β)-3-Oxoandrost-4-en-17-yl hydrogen sulfate

  • Molecular FormulaC19H28O5S
  • Average mass368.488 Da
  • Monoisotopic mass368.165741 Da
  • ChemSpider ID59693695

  • defined stereocentres - 4 of 6 defined stereocentres

More details:

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

(9ξ,14ξ,17β)-3-Oxoandrost-4-en-17-yl hydrogen sulfate [ACD/IUPAC Name]
(9ξ,14ξ,17β)-3-Oxoandrost-4-en-17-ylhydrogensulfat [German] [ACD/IUPAC Name]
Androst-4-en-3-one, 17-(sulfooxy)-, (9ξ,14ξ,17β)- [ACD/Index Name]
Hydrogénosulfate de (9ξ,14ξ,17β)-3-oxoandrost-4-én-17-yle [French] [ACD/IUPAC Name]
[(2R,10R,14S,15S)-2,15-dimethyl-5-oxotetracyclo[8.7.0.02,7.011,15]heptadec-6-en-14-yl]oxidanesulfonic acid
epitestosterone sulfate

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.578
Molar Refractivity: 93.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.74
ACD/LogD (pH 5.5): -1.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 89 Å2
Polarizability: 37.1±0.5 10-24cm3
Surface Tension: 53.6±5.0 dyne/cm
Molar Volume: 282.3±5.0 cm3

Click to predict properties on the Chemicalize site


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