ChemSpider 2D Image | (5xi,8xi,9beta,17xi,20xi)-9,19-Cyclolanost-25-ene-3,24-diol | C30H50O2

(5ξ,8ξ,9β,17ξ,20ξ)-9,19-Cyclolanost-25-ene-3,24-diol

  • Molecular FormulaC30H50O2
  • Average mass442.717 Da
  • Monoisotopic mass442.381073 Da
  • ChemSpider ID129310714

  • defined stereocentres - 4 of 10 defined stereocentres

More details:

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

(5ξ,8ξ,9β,17ξ,20ξ)-9,19-Cyclolanost-25-en-3,24-diol [German] [ACD/IUPAC Name]
(5ξ,8ξ,9β,17ξ,20ξ)-9,19-Cyclolanost-25-ene-3,24-diol [ACD/IUPAC Name]
(5ξ,8ξ,9β,17ξ,20ξ)-9,19-Cyclolanost-25-ène-3,24-diol [French] [ACD/IUPAC Name]
9,19-Cyclolanost-25-ene-3,24-diol, (5ξ,8ξ,9β,17ξ,20ξ)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 537.7±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 93.7±6.0 kJ/mol
Flash Point: 218.9±17.2 °C
Index of Refraction: 1.546
Molar Refractivity: 133.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 8.88
ACD/LogD (pH 5.5): 7.78
ACD/BCF (pH 5.5): 481197.06
ACD/KOC (pH 5.5): 406423.00
ACD/LogD (pH 7.4): 7.78
ACD/BCF (pH 7.4): 481197.06
ACD/KOC (pH 7.4): 406423.00
Polar Surface Area: 40 Å2
Polarizability: 52.8±0.5 10-24cm3
Surface Tension: 42.3±5.0 dyne/cm
Molar Volume: 420.9±5.0 cm3

Click to predict properties on the Chemicalize site


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