ChemSpider 2D Image | 3-Oxolanosta-7,9(11),24-trien-21-oic acid | C30H44O3

3-Oxolanosta-7,9(11),24-trien-21-oic acid

  • Molecular FormulaC30H44O3
  • Average mass452.669 Da
  • Monoisotopic mass452.329041 Da
  • ChemSpider ID28945674

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

3-Oxolanosta-7,9(11),24-trien-21-oic acid [ACD/IUPAC Name]
3-Oxolanosta-7,9(11),24-trien-21-säure [German] [ACD/IUPAC Name]
Acide 3-oxolanosta-7,9(11),24-trién-21-oïque [French] [ACD/IUPAC Name]
Lanosta-7,9(11),24-trien-21-oic acid, 3-oxo- [ACD/Index Name]
dehydrotrametenonic acid

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

Density: 1.1±0.1 g/cm3
Boiling Point: 583.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.5 mmHg at 25°C
Enthalpy of Vaporization: 95.3±6.0 kJ/mol
Flash Point: 320.9±26.6 °C
Index of Refraction: 1.552
Molar Refractivity: 133.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 8.20
ACD/LogD (pH 5.5): 6.37
ACD/BCF (pH 5.5): 24630.75
ACD/KOC (pH 5.5): 26482.55
ACD/LogD (pH 7.4): 4.57
ACD/BCF (pH 7.4): 387.65
ACD/KOC (pH 7.4): 416.79
Polar Surface Area: 54 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 43.2±5.0 dyne/cm
Molar Volume: 418.2±5.0 cm3

Click to predict properties on the Chemicalize site


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