ChemSpider 2D Image | (20R)-26-Hydroxycholestan-6-one | C27H46O2

(20R)-26-Hydroxycholestan-6-one

  • Molecular FormulaC27H46O2
  • Average mass402.653 Da
  • Monoisotopic mass402.349792 Da
  • ChemSpider ID24769531

  • defined stereocentres - 7 of 9 defined stereocentres

More details:

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

(20R)-26-Hydroxycholestan-6-on [German] [ACD/IUPAC Name]
(20R)-26-Hydroxycholestan-6-one [ACD/IUPAC Name]
(20R)-26-Hydroxycholestan-6-one [French] [ACD/IUPAC Name]
Cholestan-6-one, 26-hydroxy-, (20R)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 505.4±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 89.2±6.0 kJ/mol
Flash Point: 214.0±15.2 °C
Index of Refraction: 1.509
Molar Refractivity: 120.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 7.63
ACD/LogD (pH 5.5): 6.31
ACD/BCF (pH 5.5): 36822.32
ACD/KOC (pH 5.5): 64566.34
ACD/LogD (pH 7.4): 6.31
ACD/BCF (pH 7.4): 36822.32
ACD/KOC (pH 7.4): 64566.34
Polar Surface Area: 37 Å2
Polarizability: 47.7±0.5 10-24cm3
Surface Tension: 37.0±3.0 dyne/cm
Molar Volume: 403.2±3.0 cm3

Click to predict properties on the Chemicalize site


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