ChemSpider 2D Image | (3beta,5beta,6beta)-6-Hydroxy-5-methyl-20-oxo-19-norpregn-9-en-3-yl acetate | C23H34O4

(3β,5β,6β)-6-Hydroxy-5-methyl-20-oxo-19-norpregn-9-en-3-yl acetate

  • Molecular FormulaC23H34O4
  • Average mass374.514 Da
  • Monoisotopic mass374.245697 Da
  • ChemSpider ID24726413

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(3β,5β,6β)-6-Hydroxy-5-methyl-20-oxo-19-norpregn-9-en-3-yl acetate [ACD/IUPAC Name]
(3β,5β,6β)-6-Hydroxy-5-methyl-20-oxo-19-norpregn-9-en-3-yl-acetat [German] [ACD/IUPAC Name]
Acétate de (3β,5β,6β)-6-hydroxy-5-méthyl-20-oxo-19-norprégn-9-én-3-yle [French] [ACD/IUPAC Name]
Ethanone, 1-[(3β,5β,6β,17β)-3-(acetyloxy)-6-hydroxy-5-methylestr-9-en-17-yl]- [ACD/Index 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: 491.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 87.3±6.0 kJ/mol
Flash Point: 162.9±22.2 °C
Index of Refraction: 1.548
Molar Refractivity: 103.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.70
ACD/LogD (pH 5.5): 4.01
ACD/BCF (pH 5.5): 653.39
ACD/KOC (pH 5.5): 3603.31
ACD/LogD (pH 7.4): 4.01
ACD/BCF (pH 7.4): 653.39
ACD/KOC (pH 7.4): 3603.31
Polar Surface Area: 64 Å2
Polarizability: 40.9±0.5 10-24cm3
Surface Tension: 45.3±5.0 dyne/cm
Molar Volume: 325.2±5.0 cm3

Click to predict properties on the Chemicalize site


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