ChemSpider 2D Image | (8xi,9xi,10xi,13xi,14xi)-6-Chloro-16-methylene-3,20-dioxopregna-4,6-dien-17-yl acetate | C24H29ClO4

(8ξ,9ξ,10ξ,13ξ,14ξ)-6-Chloro-16-methylene-3,20-dioxopregna-4,6-dien-17-yl acetate

  • Molecular FormulaC24H29ClO4
  • Average mass416.938 Da
  • Monoisotopic mass416.175446 Da
  • ChemSpider ID22889247

  • defined stereocentres - 1 of 6 defined stereocentres

More details:

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

(8ξ,9ξ,10ξ,13ξ,14ξ)-6-Chlor-16-methylen-3,20-dioxopregna-4,6-dien-17-yl-acetat [German] [ACD/IUPAC Name]
(8ξ,9ξ,10ξ,13ξ,14ξ)-6-Chloro-16-methylene-3,20-dioxopregna-4,6-dien-17-yl acetate [ACD/IUPAC Name]
Acétate de (8ξ,9ξ,10ξ,13ξ,14ξ)-6-chloro-16-méthylène-3,20-dioxoprégna-4,6-dién-17-yle [French] [ACD/IUPAC Name]
Pregna-4,6-diene-3,20-dione, 17-(acetyloxy)-6-chloro-16-methylene-, (8ξ,9ξ,10ξ,13ξ,14ξ)- [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: 521.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.5±3.0 kJ/mol
Flash Point: 172.7±29.1 °C
Index of Refraction: 1.566
Molar Refractivity: 110.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.81
ACD/LogD (pH 5.5): 4.01
ACD/BCF (pH 5.5): 655.77
ACD/KOC (pH 5.5): 3612.71
ACD/LogD (pH 7.4): 4.01
ACD/BCF (pH 7.4): 655.77
ACD/KOC (pH 7.4): 3612.71
Polar Surface Area: 60 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 45.8±5.0 dyne/cm
Molar Volume: 339.8±5.0 cm3

Click to predict properties on the Chemicalize site


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