ChemSpider 2D Image | (3beta,5alpha,17beta)-Androstane-3,17-diyl bis(bromoacetate) | C23H34Br2O4

(3β,5α,17β)-Androstane-3,17-diyl bis(bromoacetate)

  • Molecular FormulaC23H34Br2O4
  • Average mass534.322 Da
  • Monoisotopic mass532.082397 Da
  • ChemSpider ID2340317

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(3β,5α,17β)-Androstan-3,17-diyl-bis(bromacetat) [German] [ACD/IUPAC Name]
(3β,5α,17β)-Androstane-3,17-diyl bis(bromoacetate) [ACD/IUPAC Name]
Acetic acid, 2-bromo-, (3β,5α,17β)-androstane-3,17-diyl ester [ACD/Index Name]
Bis(bromoacétate) de (3β,5α,17β)-androstane-3,17-diyle [French] [ACD/IUPAC Name]
121520-97-6 [RN]
5-Dihydrotestosterone 3,17-bromoacetate
5α-Androstan-3,17-dibromoacetyloxy
5α-Dihydrotestosterone 3,17-bromoacetate
Androstane-3,17-diol, bis(bromoacetate), (3β,5α,17β)-
Dht-3,17-bromoacetate

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

Density: 1.5±0.1 g/cm3
Boiling Point: 523.6±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.7±3.0 kJ/mol
Flash Point: 270.5±23.2 °C
Index of Refraction: 1.563
Molar Refractivity: 119.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 7.44
ACD/LogD (pH 5.5): 6.45
ACD/BCF (pH 5.5): 46726.09
ACD/KOC (pH 5.5): 76569.05
ACD/LogD (pH 7.4): 6.45
ACD/BCF (pH 7.4): 46726.09
ACD/KOC (pH 7.4): 76569.05
Polar Surface Area: 53 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 48.5±5.0 dyne/cm
Molar Volume: 367.8±5.0 cm3

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