ChemSpider 2D Image | (7beta,8alpha,12beta,13alpha)-Beyer-15-ene-7,12,17-triol | C20H32O3

(7β,8α,12β,13α)-Beyer-15-ene-7,12,17-triol

  • Molecular FormulaC20H32O3
  • Average mass320.466 Da
  • Monoisotopic mass320.235138 Da
  • ChemSpider ID28668883

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(7β,8α,12β,13α)-Beyer-15-ene-7,12,17-triol [ACD/IUPAC Name]
(7β,8α,12β,13α)-Beyer-15-ène-7,12,17-triol [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 466.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 83.9±6.0 kJ/mol
Flash Point: 210.6±23.3 °C
Index of Refraction: 1.583
Molar Refractivity: 90.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.86
ACD/LogD (pH 5.5): 3.25
ACD/BCF (pH 5.5): 173.72
ACD/KOC (pH 5.5): 1396.01
ACD/LogD (pH 7.4): 3.25
ACD/BCF (pH 7.4): 173.72
ACD/KOC (pH 7.4): 1396.01
Polar Surface Area: 61 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 51.6±5.0 dyne/cm
Molar Volume: 272.0±5.0 cm3

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