ChemSpider 2D Image | (3beta,22R)-3,22-Dihydroxylanosta-8,24-dien-11-one | C30H48O3

(3β,22R)-3,22-Dihydroxylanosta-8,24-dien-11-one

  • Molecular FormulaC30H48O3
  • Average mass456.700 Da
  • Monoisotopic mass456.360352 Da
  • ChemSpider ID78437184

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(3β,22R)-3,22-Dihydroxylanosta-8,24-dien-11-on [German] [ACD/IUPAC Name]
(3β,22R)-3,22-Dihydroxylanosta-8,24-dien-11-one [ACD/IUPAC Name]
(3β,22R)-3,22-Dihydroxylanosta-8,24-dién-11-one [French] [ACD/IUPAC Name]
Lanosta-8,24-dien-11-one, 3,22-dihydroxy-, (3β,22R)- [ACD/Index Name]
Inonotsuoxodiol A

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

Density: 1.1±0.1 g/cm3
Boiling Point: 568.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.5 mmHg at 25°C
Enthalpy of Vaporization: 98.0±6.0 kJ/mol
Flash Point: 311.7±26.6 °C
Index of Refraction: 1.546
Molar Refractivity: 135.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.56
ACD/LogD (pH 5.5): 6.68
ACD/BCF (pH 5.5): 70002.07
ACD/KOC (pH 5.5): 102261.18
ACD/LogD (pH 7.4): 6.68
ACD/BCF (pH 7.4): 70002.07
ACD/KOC (pH 7.4): 102261.18
Polar Surface Area: 58 Å2
Polarizability: 53.5±0.5 10-24cm3
Surface Tension: 43.0±5.0 dyne/cm
Molar Volume: 426.5±5.0 cm3

Click to predict properties on the Chemicalize site


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