ChemSpider 2D Image | Methyl 16-hydroxykauran-18-oate | C21H34O3

Methyl 16-hydroxykauran-18-oate

  • Molecular FormulaC21H34O3
  • Average mass334.493 Da
  • Monoisotopic mass334.250793 Da
  • ChemSpider ID24650907

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

16-Hydroxykauran-18-oate de méthyle [French] [ACD/IUPAC Name]
Methyl 16-hydroxykauran-18-oate [ACD/IUPAC Name]
Methyl-16-hydroxykauran-18-oat [German] [ACD/IUPAC 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: 421.7±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.0±6.0 kJ/mol
Flash Point: 161.8±19.5 °C
Index of Refraction: 1.537
Molar Refractivity: 94.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.23
ACD/LogD (pH 5.5): 5.25
ACD/BCF (pH 5.5): 5714.77
ACD/KOC (pH 5.5): 17015.79
ACD/LogD (pH 7.4): 5.25
ACD/BCF (pH 7.4): 5714.77
ACD/KOC (pH 7.4): 17015.79
Polar Surface Area: 47 Å2
Polarizability: 37.5±0.5 10-24cm3
Surface Tension: 43.0±5.0 dyne/cm
Molar Volume: 302.5±5.0 cm3

Click to predict properties on the Chemicalize site


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