ChemSpider 2D Image | (3beta,5xi,24E)-3-Hydroxy-7-oxolanosta-8,24-dien-26-al | C30H46O3

(3β,5ξ,24E)-3-Hydroxy-7-oxolanosta-8,24-dien-26-al

  • Molecular FormulaC30H46O3
  • Average mass454.684 Da
  • Monoisotopic mass454.344696 Da
  • ChemSpider ID57257097

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 6 of 7 defined stereocentres

More details:

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

(3β,5ξ,24E)-3-Hydroxy-7-oxolanosta-8,24-dien-26-al [German] [ACD/IUPAC Name]
(3β,5ξ,24E)-3-Hydroxy-7-oxolanosta-8,24-dien-26-al [ACD/IUPAC Name]
(3β,5ξ,24E)-3-Hydroxy-7-oxolanosta-8,24-dién-26-al [French] [ACD/IUPAC Name]
Lanosta-8,24-dien-26-al, 3-hydroxy-7-oxo-, (3β,5ξ,24E)- [ACD/Index Name]
252351-96-5 [RN]
Lucidal

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

Density: 1.1±0.1 g/cm3
Boiling Point: 570.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 98.2±6.0 kJ/mol
Flash Point: 312.6±26.6 °C
Index of Refraction: 1.542
Molar Refractivity: 133.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.87
ACD/LogD (pH 5.5): 6.68
ACD/BCF (pH 5.5): 70764.10
ACD/KOC (pH 5.5): 103056.83
ACD/LogD (pH 7.4): 6.68
ACD/BCF (pH 7.4): 70764.10
ACD/KOC (pH 7.4): 103056.83
Polar Surface Area: 54 Å2
Polarizability: 53.1±0.5 10-24cm3
Surface Tension: 42.4±5.0 dyne/cm
Molar Volume: 425.6±5.0 cm3

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