ChemSpider 2D Image | Methyl 3,7,11,12,15,23-hexaoxolanost-8-en-26-oate | C31H40O8

Methyl 3,7,11,12,15,23-hexaoxolanost-8-en-26-oate

  • Molecular FormulaC31H40O8
  • Average mass540.644 Da
  • Monoisotopic mass540.272339 Da
  • ChemSpider ID29416438

  • defined stereocentres - 6 of 7 defined stereocentres

More details:

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

3,7,11,12,15,23-Hexaoxolanost-8-én-26-oate de méthyle [French] [ACD/IUPAC Name]
Lanost-8-en-26-oic acid, 3,7,11,12,15,23-hexaoxo-, methyl ester [ACD/Index Name]
Methyl 3,7,11,12,15,23-hexaoxolanost-8-en-26-oate [ACD/IUPAC Name]
Methyl-3,7,11,12,15,23-hexaoxolanost-8-en-26-oat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 657.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.8±3.0 kJ/mol
Flash Point: 274.4±31.5 °C
Index of Refraction: 1.545
Molar Refractivity: 139.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 2.77
ACD/LogD (pH 5.5): 2.55
ACD/BCF (pH 5.5): 51.09
ACD/KOC (pH 5.5): 581.35
ACD/LogD (pH 7.4): 2.55
ACD/BCF (pH 7.4): 51.09
ACD/KOC (pH 7.4): 581.35
Polar Surface Area: 129 Å2
Polarizability: 55.3±0.5 10-24cm3
Surface Tension: 49.2±5.0 dyne/cm
Molar Volume: 441.0±5.0 cm3

Click to predict properties on the Chemicalize site


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