ChemSpider 2D Image | (3beta,22R)-3,22-Dihydroxy-24-methylenelanost-8-en-28-oic acid | C31H50O4

(3β,22R)-3,22-Dihydroxy-24-methylenelanost-8-en-28-oic acid

  • Molecular FormulaC31H50O4
  • Average mass486.726 Da
  • Monoisotopic mass486.370911 Da
  • ChemSpider ID78441166

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(3β,22R)-3,22-Dihydroxy-24-methylenelanost-8-en-28-oic acid [ACD/IUPAC Name]
(3β,22R)-3,22-Dihydroxy-24-methylenlanost-8-en-28-säure [German] [ACD/IUPAC Name]
Acide (3β,22R)-3,22-dihydroxy-24-méthylènelanost-8-én-28-oïque [French] [ACD/IUPAC Name]
Lanost-8-en-28-oic acid, 3,22-dihydroxy-24-methylene-, (3β,22R)- [ACD/Index Name]
Gilvsin B

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

Density: 1.1±0.1 g/cm3
Boiling Point: 602.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.9 mmHg at 25°C
Enthalpy of Vaporization: 102.8±6.0 kJ/mol
Flash Point: 332.2±28.0 °C
Index of Refraction: 1.550
Molar Refractivity: 141.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 7.83
ACD/LogD (pH 5.5): 6.16
ACD/BCF (pH 5.5): 14184.19
ACD/KOC (pH 5.5): 14488.95
ACD/LogD (pH 7.4): 4.37
ACD/BCF (pH 7.4): 232.54
ACD/KOC (pH 7.4): 237.54
Polar Surface Area: 78 Å2
Polarizability: 55.9±0.5 10-24cm3
Surface Tension: 45.4±5.0 dyne/cm
Molar Volume: 442.4±5.0 cm3

Click to predict properties on the Chemicalize site


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