ChemSpider 2D Image | (8alpha,9beta,10alpha,13alpha)-13-Hydroxy-15-oxokaur-16-en-18-oic acid | C20H28O4

(8α,9β,10α,13α)-13-Hydroxy-15-oxokaur-16-en-18-oic acid

  • Molecular FormulaC20H28O4
  • Average mass332.434 Da
  • Monoisotopic mass332.198761 Da
  • ChemSpider ID65791824

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(8α,9β,10α,13α)-13-Hydroxy-15-oxokaur-16-en-18-oic acid [ACD/IUPAC Name]
(8α,9β,10α,13α)-13-Hydroxy-15-oxokaur-16-en-18-säure [German] [ACD/IUPAC Name]
Acide (8α,9β,10α,13α)-13-hydroxy-15-oxokaur-16-én-18-oïque [French] [ACD/IUPAC Name]
15-oxo-steviol

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

Density: 1.2±0.1 g/cm3
Boiling Point: 513.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 90.4±6.0 kJ/mol
Flash Point: 278.5±26.6 °C
Index of Refraction: 1.578
Molar Refractivity: 89.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.42
ACD/LogD (pH 5.5): 2.03
ACD/BCF (pH 5.5): 12.27
ACD/KOC (pH 5.5): 112.87
ACD/LogD (pH 7.4): 0.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.77
Polar Surface Area: 75 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 52.5±5.0 dyne/cm
Molar Volume: 269.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement