ChemSpider 2D Image | (1alpha,3beta,5beta,7beta,8alpha,9beta,10alpha,11beta)-1,3,7-Trihydroxy-17-methoxy-6,15-dioxokauran-11-yl acetate | C23H34O8

(1α,3β,5β,7β,8α,9β,10α,11β)-1,3,7-Trihydroxy-17-methoxy-6,15-dioxokauran-11-yl acetate

  • Molecular FormulaC23H34O8
  • Average mass438.511 Da
  • Monoisotopic mass438.225372 Da
  • ChemSpider ID29420450

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(1α,3β,5β,7β,8α,9β,10α,11β)-1,3,7-Trihydroxy-17-methoxy-6,15-dioxokauran-11-yl acetate [ACD/IUPAC Name]
(1α,3β,5β,7β,8α,9β,10α,11β)-1,3,7-Trihydroxy-17-methoxy-6,15-dioxokauran-11-yl-acetat [German] [ACD/IUPAC Name]
Acétate de (1α,3β,5β,7β,8α,9β,10α,11β)-1,3,7-trihydroxy-17-méthoxy-6,15-dioxokauran-11-yle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 600.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.9 mmHg at 25°C
Enthalpy of Vaporization: 102.6±6.0 kJ/mol
Flash Point: 202.4±25.0 °C
Index of Refraction: 1.569
Molar Refractivity: 108.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.62
ACD/LogD (pH 5.5): 0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 28.70
ACD/LogD (pH 7.4): 0.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 28.69
Polar Surface Area: 130 Å2
Polarizability: 43.1±0.5 10-24cm3
Surface Tension: 57.4±5.0 dyne/cm
Molar Volume: 331.8±5.0 cm3

Click to predict properties on the Chemicalize site


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