ChemSpider 2D Image | 16-Hydroxy-3-oxoolean-12-en-28-oic acid | C30H46O4

16-Hydroxy-3-oxoolean-12-en-28-oic acid

  • Molecular FormulaC30H46O4
  • Average mass470.684 Da
  • Monoisotopic mass470.339600 Da
  • ChemSpider ID35014974

More details:

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

16-Hydroxy-3-oxoolean-12-en-28-oic acid [ACD/IUPAC Name]
16-Hydroxy-3-oxoolean-12-en-28-säure [German] [ACD/IUPAC Name]
Acide 16-hydroxy-3-oxooléan-12-én-28-oïque [French] [ACD/IUPAC Name]
Olean-12-en-28-oic acid, 16-hydroxy-3-oxo- [ACD/Index Name]
16-Hydroxy-3-oxo-12-oleanen-28-oic acid
5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-oxo-3,4,5,6,7,8,8a,11,12,12b,13,14b-dodecahydro-1H-picene-4a-carboxylic acid

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

Density: 1.1±0.1 g/cm3
Boiling Point: 583.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 100.1±6.0 kJ/mol
Flash Point: 320.7±26.6 °C
Index of Refraction: 1.563
Molar Refractivity: 133.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 7.00
ACD/LogD (pH 5.5): 5.79
ACD/BCF (pH 5.5): 7913.20
ACD/KOC (pH 5.5): 10199.41
ACD/LogD (pH 7.4): 3.99
ACD/BCF (pH 7.4): 126.39
ACD/KOC (pH 7.4): 162.91
Polar Surface Area: 75 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 47.8±5.0 dyne/cm
Molar Volume: 411.7±5.0 cm3

Click to predict properties on the Chemicalize site


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