ChemSpider 2D Image | (1beta,5xi,7alpha,9xi,10alpha,13alpha)-13-Hydroxy-15-oxokaur-16-ene-1,7,11,14-tetrayl tetraacetate | C28H38O10

(1β,5ξ,7α,9ξ,10α,13α)-13-Hydroxy-15-oxokaur-16-ene-1,7,11,14-tetrayl tetraacetate

  • Molecular FormulaC28H38O10
  • Average mass534.595 Da
  • Monoisotopic mass534.246521 Da
  • ChemSpider ID2032907

  • defined stereocentres - 4 of 9 defined stereocentres

More details:

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

(1β,5ξ,7α,9ξ,10α,13α)-13-Hydroxy-15-oxokaur-16-en-1,7,11,14-tetrayl-tetraacetat [German] [ACD/IUPAC Name]
(1β,5ξ,7α,9ξ,10α,13α)-13-Hydroxy-15-oxokaur-16-ene-1,7,11,14-tetrayl tetraacetate [ACD/IUPAC Name]
Tetraacétate de (1β,5ξ,7α,9ξ,10α,13α)-13-hydroxy-15-oxokaur-16-ène-1,7,11,14-tétrayle [French] [ACD/IUPAC Name]
(1β,7α,10α,13α)-1,11,14-tris(acetyloxy)-13-hydroxy-15-oxokaur-16-en-7-yl acetate
(1β,7α,10α,13α)-1,11,14-tris(acetyloxy)-13-hydroxy-15-oxokaur-16-en-7-yl acetate (en)

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

Density: 1.3±0.1 g/cm3
Boiling Point: 592.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.8 mmHg at 25°C
Enthalpy of Vaporization: 101.5±6.0 kJ/mol
Flash Point: 186.0±23.6 °C
Index of Refraction: 1.545
Molar Refractivity: 132.0±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 2.79
ACD/LogD (pH 5.5): 3.27
ACD/BCF (pH 5.5): 179.75
ACD/KOC (pH 5.5): 1430.56
ACD/LogD (pH 7.4): 3.27
ACD/BCF (pH 7.4): 179.72
ACD/KOC (pH 7.4): 1430.33
Polar Surface Area: 143 Å2
Polarizability: 52.3±0.5 10-24cm3
Surface Tension: 51.1±5.0 dyne/cm
Molar Volume: 417.6±5.0 cm3

Click to predict properties on the Chemicalize site


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