ChemSpider 2D Image | (5alpha,17beta)-3-Oxoandrostan-17-yl undecanoate | C30H50O3

(5α,17β)-3-Oxoandrostan-17-yl undecanoate

  • Molecular FormulaC30H50O3
  • Average mass458.716 Da
  • Monoisotopic mass458.376007 Da
  • ChemSpider ID31046138
  • defined stereocentres - 7 of 7 defined stereocentres


More details:






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

(5α,17β)-3-Oxoandrostan-17-yl undecanoate [ACD/IUPAC Name]
(5α,17β)-3-Oxoandrostan-17-yl-undecanoat [German] [ACD/IUPAC Name]
Undécanoate de (5α,17β)-3-oxoandrostan-17-yle [French] [ACD/IUPAC Name]
Undecanoic acid, (5α,17β)-3-oxoandrostan-17-yl ester [ACD/Index Name]
5a-Dihydro Testosterone Undecanoate
6804-12-2 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 537.7±43.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.5±3.0 kJ/mol
Flash Point: 224.1±28.2 °C
Index of Refraction: 1.513
Molar Refractivity: 134.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 9.43
ACD/LogD (pH 5.5): 9.18
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 2360282.00
ACD/LogD (pH 7.4): 9.18
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 2360282.00
Polar Surface Area: 43 Å2
Polarizability: 53.4±0.5 10-24cm3
Surface Tension: 40.1±5.0 dyne/cm
Molar Volume: 447.8±5.0 cm3

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