ChemSpider 2D Image | (3alpha,5beta)-3,14-Dihydroxy-3-methylcard-20(22)-enolide | C24H36O4

(3α,5β)-3,14-Dihydroxy-3-methylcard-20(22)-enolide

  • Molecular FormulaC24H36O4
  • Average mass388.540 Da
  • Monoisotopic mass388.261353 Da
  • ChemSpider ID34243230

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(3α,5β)-3,14-Dihydroxy-3-methylcard-20(22)-enolid [German] [ACD/IUPAC Name]
(3α,5β)-3,14-Dihydroxy-3-methylcard-20(22)-enolide [ACD/IUPAC Name]
(3α,5β)-3,14-Dihydroxy-3-méthylcard-20(22)-énolide [French] [ACD/IUPAC Name]
Card-20(22)-enolide, 3,14-dihydroxy-3-methyl-, (3α,5β)- [ACD/Index 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: 548.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 95.2±6.0 kJ/mol
Flash Point: 184.9±23.6 °C
Index of Refraction: 1.580
Molar Refractivity: 107.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.33
ACD/LogD (pH 5.5): 3.23
ACD/BCF (pH 5.5): 167.57
ACD/KOC (pH 5.5): 1360.46
ACD/LogD (pH 7.4): 3.23
ACD/BCF (pH 7.4): 167.57
ACD/KOC (pH 7.4): 1360.46
Polar Surface Area: 67 Å2
Polarizability: 42.5±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 322.5±3.0 cm3

Click to predict properties on the Chemicalize site


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