ChemSpider 2D Image | (5alpha,22S,24R)-22-Hydroxyergostan-3-one | C28H48O2

(5α,22S,24R)-22-Hydroxyergostan-3-one

  • Molecular FormulaC28H48O2
  • Average mass416.680 Da
  • Monoisotopic mass416.365417 Da
  • ChemSpider ID26331605

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(5α,22S,24R)-22-Hydroxyergostan-3-on [German] [ACD/IUPAC Name]
(5α,22S,24R)-22-Hydroxyergostan-3-one [ACD/IUPAC Name]
(5α,22S,24R)-22-Hydroxyergostan-3-one [French] [ACD/IUPAC Name]
Ergostan-3-one, 22-hydroxy-, (5α,22S,24R)- [ACD/Index Name]
(22&α;)-hydroxy-5&α;-campestan-3-one
(22<i>S</i>)-22-hydroxy-5&amp;α;-campestan-3-one
(22<i>S</i>,24<i>R&lt;/i>)-22-hydroxy-5&α;-ergostan-3-one
(22S)-22-hydroxy-5α-campestan-3-one
(22S, 24R)-22-hydroxy-5α-ergostan-3-one
(22s,24r)-22-hydroxy-5??-ergostan-3-one
More...

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

8005941 [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 509.8±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 89.8±6.0 kJ/mol
Flash Point: 215.8±15.2 °C
Index of Refraction: 1.506
Molar Refractivity: 125.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 7.80
ACD/LogD (pH 5.5): 6.57
ACD/BCF (pH 5.5): 58079.18
ACD/KOC (pH 5.5): 89467.91
ACD/LogD (pH 7.4): 6.57
ACD/BCF (pH 7.4): 58079.18
ACD/KOC (pH 7.4): 89467.91
Polar Surface Area: 37 Å2
Polarizability: 49.5±0.5 10-24cm3
Surface Tension: 36.1±3.0 dyne/cm
Molar Volume: 420.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement