ChemSpider 2D Image | (3beta,5xi)-3-Hydroxybeyer-15-en-2-one | C20H30O2

(3β,5ξ)-3-Hydroxybeyer-15-en-2-one

  • Molecular FormulaC20H30O2
  • Average mass302.451 Da
  • Monoisotopic mass302.224579 Da
  • ChemSpider ID22913812

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

(3β,5ξ)-3-Hydroxybeyer-15-en-2-one [ACD/IUPAC Name]
(3β,5ξ)-3-Hydroxybeyer-15-én-2-one [French] [ACD/IUPAC 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: 412.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 76.8±6.0 kJ/mol
Flash Point: 176.1±21.3 °C
Index of Refraction: 1.557
Molar Refractivity: 88.0±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.41
ACD/LogD (pH 5.5): 4.45
ACD/BCF (pH 5.5): 1413.16
ACD/KOC (pH 5.5): 6259.00
ACD/LogD (pH 7.4): 4.45
ACD/BCF (pH 7.4): 1413.16
ACD/KOC (pH 7.4): 6258.99
Polar Surface Area: 37 Å2
Polarizability: 34.9±0.5 10-24cm3
Surface Tension: 43.4±5.0 dyne/cm
Molar Volume: 273.5±5.0 cm3

Click to predict properties on the Chemicalize site


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