ChemSpider 2D Image | (3beta,5alpha,17beta)-17-[(1R)-1-Hydroxy-1-(2-piperidinyl)ethyl]androstan-3-ol | C26H45NO2

(3β,5α,17β)-17-[(1R)-1-Hydroxy-1-(2-piperidinyl)ethyl]androstan-3-ol

  • Molecular FormulaC26H45NO2
  • Average mass403.641 Da
  • Monoisotopic mass403.345032 Da
  • ChemSpider ID25045109

  • defined stereocentres - 9 of 10 defined stereocentres

More details:

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

(3β,5α,17β)-17-[(1R)-1-Hydroxy-1-(2-piperidinyl)ethyl]androstan-3-ol [German] [ACD/IUPAC Name]
(3β,5α,17β)-17-[(1R)-1-Hydroxy-1-(2-piperidinyl)ethyl]androstan-3-ol [ACD/IUPAC Name]
(3β,5α,17β)-17-[(1R)-1-Hydroxy-1-(2-pipéridinyl)éthyl]androstan-3-ol [French] [ACD/IUPAC Name]
623550-27-6 [RN]
Androstan-3-ol, 17-[(1R)-1-hydroxy-1-(2-piperidinyl)ethyl]-, (3β,5α,17β)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 526.3±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 92.1±6.0 kJ/mol
Flash Point: 58.4±12.4 °C
Index of Refraction: 1.540
Molar Refractivity: 118.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.64
ACD/LogD (pH 5.5): 2.04
ACD/BCF (pH 5.5): 3.80
ACD/KOC (pH 5.5): 11.93
ACD/LogD (pH 7.4): 2.32
ACD/BCF (pH 7.4): 7.21
ACD/KOC (pH 7.4): 22.67
Polar Surface Area: 52 Å2
Polarizability: 46.9±0.5 10-24cm3
Surface Tension: 42.3±3.0 dyne/cm
Molar Volume: 376.9±3.0 cm3

Click to predict properties on the Chemicalize site


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