ChemSpider 2D Image | Methyl 10-acetoxy-2,2,4a,8a,9,12b,14a-heptamethylicosahydro-6a(1H)-picenecarboxylate | C33H54O4

Methyl 10-acetoxy-2,2,4a,8a,9,12b,14a-heptamethylicosahydro-6a(1H)-picenecarboxylate

  • Molecular FormulaC33H54O4
  • Average mass514.779 Da
  • Monoisotopic mass514.402222 Da
  • ChemSpider ID549114

More details:

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

10-Acétoxy-2,2,4a,8a,9,12b,14a-heptaméthylicosahydro-6a(1H)-picènecarboxylate de méthyle [French] [ACD/IUPAC Name]
6a(1H)-Picenecarboxylic acid, 10-(acetyloxy)eicosahydro-2,2,4a,8a,9,12b,14a-heptamethyl-, methyl ester [ACD/Index Name]
Methyl 10-(acetyloxy)-2,2,4a,8a,9,12b,14a-heptamethylicosahydro-6a(1H)-picenecarboxylate
Methyl 10-acetoxy-2,2,4a,8a,9,12b,14a-heptamethylicosahydro-6a(1H)-picenecarboxylate [ACD/IUPAC Name]
Methyl-10-acetoxy-2,2,4a,8a,9,12b,14a-heptamethylicosahydro-6a(1H)-picencarboxylat [German] [ACD/IUPAC Name]
D:A-Friedooleanan-26-oic acid, 3-(acetyloxy)-, methyl ester, (3α)-
D:A-Friedooleanan-26-oic acid, 3-(acetyloxy)-, methyl ester, (3β)-

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

Density: 1.1±0.1 g/cm3
Boiling Point: 531.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.7±3.0 kJ/mol
Flash Point: 249.0±28.5 °C
Index of Refraction: 1.524
Molar Refractivity: 148.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 10.70
ACD/LogD (pH 5.5): 10.00
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 6551625.00
ACD/LogD (pH 7.4): 10.00
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 6551625.00
Polar Surface Area: 53 Å2
Polarizability: 58.8±0.5 10-24cm3
Surface Tension: 40.5±5.0 dyne/cm
Molar Volume: 484.8±5.0 cm3

Click to predict properties on the Chemicalize site


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