ChemSpider 2D Image | (3alpha,5beta,8alpha,10alpha,14beta,17alpha)-Androstane-3,17-diyl dipropanoate | C25H40O4

(3α,5β,8α,10α,14β,17α)-Androstane-3,17-diyl dipropanoate

  • Molecular FormulaC25H40O4
  • Average mass404.583 Da
  • Monoisotopic mass404.292664 Da
  • ChemSpider ID62296831

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(3α,5α,8α,10α,13α,14β,17β)-Androstan-3,17-diyl-dipropanoat [German] [ACD/IUPAC Name]
(3α,5α,8α,10α,13α,14β,17β)-Androstane-3,17-diyl dipropanoate [ACD/IUPAC Name]
(3α,5β,8α,10α,14β,17α)-Androstan-3,17-diyl-dipropanoat [German] [ACD/IUPAC Name]
(3α,5β,8α,10α,14β,17α)-Androstane-3,17-diyl dipropanoate [ACD/IUPAC Name]
Androstane-3,17-diol, dipropanoate, (3α,5α,8α,10α,13α,14β,17β)- [ACD/Index Name]
Androstane-3,17-diol, dipropanoate, (3α,5β,8α,10α,14β,17α)- [ACD/Index Name]
Dipropanoate de (3α,5α,8α,10α,13α,14β,17β)-androstane-3,17-diyle [French] [ACD/IUPAC Name]
Dipropanoate de (3α,5β,8α,10α,14β,17α)-androstane-3,17-diyle [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 466.5±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.8±3.0 kJ/mol
Flash Point: 221.4±19.6 °C
Index of Refraction: 1.518
Molar Refractivity: 113.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 7.18
ACD/LogD (pH 5.5): 6.05
ACD/BCF (pH 5.5): 23319.83
ACD/KOC (pH 5.5): 46558.99
ACD/LogD (pH 7.4): 6.05
ACD/BCF (pH 7.4): 23319.83
ACD/KOC (pH 7.4): 46558.99
Polar Surface Area: 53 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 40.9±5.0 dyne/cm
Molar Volume: 373.8±5.0 cm3

Click to predict properties on the Chemicalize site


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