ChemSpider 2D Image | (17xi)-21-Hydroxypregn-4-ene-3,11,20-trione | C21H28O4

(17ξ)-21-Hydroxypregn-4-ene-3,11,20-trione

  • Molecular FormulaC21H28O4
  • Average mass344.445 Da
  • Monoisotopic mass344.198761 Da
  • ChemSpider ID24850107
  • defined stereocentres - 5 of 6 defined stereocentres


More details:






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

(17ξ)-21-Hydroxypregn-4-en-3,11,20-trion [German] [ACD/IUPAC Name]
(17ξ)-21-Hydroxypregn-4-ene-3,11,20-trione [ACD/IUPAC Name]
(17ξ)-21-Hydroxyprégn-4-ène-3,11,20-trione [French] [ACD/IUPAC Name]
Pregn-4-ene-3,11,20-trione, 21-hydroxy-, (17ξ)- [ACD/Index Name]
(1S,2R,10S,11S,15S)-14-(2-hydroxyacetyl)-2,15-dimethyltetracyclo[8.7.0.02,7.011,15]heptadec-6-ene-5,17-dione
11-Dehydrocorticosteron
11-Dehydrocorticosterone [Wiki]
11-Dehydro-Corticosterone
11-Oxo-11-deoxycorticosterone
11-Oxocorticosterone
More...

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 530.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 92.6±6.0 kJ/mol
Flash Point: 288.4±26.6 °C
Index of Refraction: 1.568
Molar Refractivity: 92.6±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.74
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 16.59
ACD/KOC (pH 5.5): 259.87
ACD/LogD (pH 7.4): 1.91
ACD/BCF (pH 7.4): 16.59
ACD/KOC (pH 7.4): 259.87
Polar Surface Area: 71 Å2
Polarizability: 36.7±0.5 10-24cm3
Surface Tension: 50.3±5.0 dyne/cm
Molar Volume: 283.2±5.0 cm3

Click to predict properties on the Chemicalize site






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