ChemSpider 2D Image | (5xi,9xi,17xi)-28-(Benzyloxy)olean-12-en-3-ol | C37H56O2

(5ξ,9ξ,17ξ)-28-(Benzyloxy)olean-12-en-3-ol

  • Molecular FormulaC37H56O2
  • Average mass532.839 Da
  • Monoisotopic mass532.428040 Da
  • ChemSpider ID8318824

  • defined stereocentres - 4 of 8 defined stereocentres

More details:

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

(5ξ,9ξ,17ξ)-28-(Benzyloxy)olean-12-en-3-ol [ACD/IUPAC Name]
(5ξ,9ξ,17ξ)-28-(Benzyloxy)olean-12-en-3-ol [German] [ACD/IUPAC Name]
(5ξ,9ξ,17ξ)-28-(Benzyloxy)oléan-12-én-3-ol [French] [ACD/IUPAC Name]
Olean-12-en-3-ol, 28-(phenylmethoxy)-, (5ξ,9ξ,17ξ)- [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: 589.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 92.5±3.0 kJ/mol
Flash Point: 235.9±24.4 °C
Index of Refraction: 1.564
Molar Refractivity: 163.0±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 11.79
ACD/LogD (pH 5.5): 10.98
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.98
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 29 Å2
Polarizability: 64.6±0.5 10-24cm3
Surface Tension: 43.8±5.0 dyne/cm
Molar Volume: 501.2±5.0 cm3

Click to predict properties on the Chemicalize site


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