ChemSpider 2D Image | Dodecyl (3beta)-17-oxoandrost-5-en-3-yl sulfate | C31H52O5S

Dodecyl (3β)-17-oxoandrost-5-en-3-yl sulfate

  • Molecular FormulaC31H52O5S
  • Average mass536.807 Da
  • Monoisotopic mass536.353516 Da
  • ChemSpider ID57525001
  • defined stereocentres - 6 of 6 defined stereocentres


More details:






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

Dodecyl (3β)-17-oxoandrost-5-en-3-yl sulfate [ACD/IUPAC Name]
Dodecyl-(3β)-17-oxoandrost-5-en-3-ylsulfat [German] [ACD/IUPAC Name]
Sulfate de dodécyle et de (3β)-17-oxoandrost-5-én-3-yle [French] [ACD/IUPAC Name]
Sulfuric acid, dodecyl (3β)-17-oxoandrost-5-en-3-yl ester [ACD/Index Name]
37785-73-2 [RN]
Dehydroepiandrosterone-lauryl-sulfate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 627.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.9±3.0 kJ/mol
Flash Point: 333.5±31.5 °C
Index of Refraction: 1.529
Molar Refractivity: 149.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 10.08
ACD/LogD (pH 5.5): 9.77
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 4912713.00
ACD/LogD (pH 7.4): 9.77
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 4912713.00
Polar Surface Area: 78 Å2
Polarizability: 59.2±0.5 10-24cm3
Surface Tension: 44.0±5.0 dyne/cm
Molar Volume: 484.4±5.0 cm3

Click to predict properties on the Chemicalize site






Advertisement