ChemSpider 2D Image | (8alpha,10alpha,18alpha)-24-Hydroxy-3-oxoolean-12-en-28-oic acid | C30H46O4

(8α,10α,18α)-24-Hydroxy-3-oxoolean-12-en-28-oic acid

  • Molecular FormulaC30H46O4
  • Average mass470.684 Da
  • Monoisotopic mass470.339600 Da
  • ChemSpider ID114813947

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(8α,10α,18α)-24-Hydroxy-3-oxoolean-12-en-28-oic acid [ACD/IUPAC Name]
(8α,10α,18α)-24-Hydroxy-3-oxoolean-12-en-28-säure [German] [ACD/IUPAC Name]
Acide (8α,10α,18α)-24-hydroxy-3-oxooléan-12-én-28-oïque [French] [ACD/IUPAC Name]
Olean-12-en-28-oic acid, 24-hydroxy-3-oxo-, (8α,10α,18α)- [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: 587.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 100.7±6.0 kJ/mol
Flash Point: 323.4±26.6 °C
Index of Refraction: 1.564
Molar Refractivity: 133.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 6.95
ACD/LogD (pH 5.5): 5.98
ACD/BCF (pH 5.5): 12386.78
ACD/KOC (pH 5.5): 16268.07
ACD/LogD (pH 7.4): 4.17
ACD/BCF (pH 7.4): 195.05
ACD/KOC (pH 7.4): 256.16
Polar Surface Area: 75 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 48.4±5.0 dyne/cm
Molar Volume: 411.1±5.0 cm3

Click to predict properties on the Chemicalize site


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