ChemSpider 2D Image | 16,21,25-Trihydroxy-21,24-cyclolanost-7-en-3-one | C30H48O4

16,21,25-Trihydroxy-21,24-cyclolanost-7-en-3-one

  • Molecular FormulaC30H48O4
  • Average mass472.700 Da
  • Monoisotopic mass472.355255 Da
  • ChemSpider ID24628029

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

16,21,25-Trihydroxy-21,24-cyclolanost-7-en-3-on [German] [ACD/IUPAC Name]
16,21,25-Trihydroxy-21,24-cyclolanost-7-en-3-one [ACD/IUPAC Name]
16,21,25-Trihydroxy-21,24-cyclolanost-7-én-3-one [French] [ACD/IUPAC Name]
21,24-Cyclolanost-7-en-3-one, 16,21,25-trihydroxy- [ACD/Index Name]
TOOSENDANONE A

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

Density: 1.1±0.1 g/cm3
Boiling Point: 591.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.8 mmHg at 25°C
Enthalpy of Vaporization: 101.3±6.0 kJ/mol
Flash Point: 325.5±26.6 °C
Index of Refraction: 1.567
Molar Refractivity: 135.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.82
ACD/LogD (pH 5.5): 4.95
ACD/BCF (pH 5.5): 3423.56
ACD/KOC (pH 5.5): 11791.61
ACD/LogD (pH 7.4): 4.95
ACD/BCF (pH 7.4): 3423.56
ACD/KOC (pH 7.4): 11791.61
Polar Surface Area: 78 Å2
Polarizability: 53.5±0.5 10-24cm3
Surface Tension: 48.5±5.0 dyne/cm
Molar Volume: 413.6±5.0 cm3

Click to predict properties on the Chemicalize site


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