ChemSpider 2D Image | (11beta,16alpha)-11-Hydroxy-16-methyl-3,20-dioxopregna-1,4-diene-17,21-diyl dipropanoate | C28H38O7

(11β,16α)-11-Hydroxy-16-methyl-3,20-dioxopregna-1,4-diene-17,21-diyl dipropanoate

  • Molecular FormulaC28H38O7
  • Average mass486.597 Da
  • Monoisotopic mass486.261749 Da
  • ChemSpider ID32700189

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(11β,16α)-11-Hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17,21-diyl-dipropanoat [German] [ACD/IUPAC Name]
(11β,16α)-11-Hydroxy-16-methyl-3,20-dioxopregna-1,4-diene-17,21-diyl dipropanoate [ACD/IUPAC Name]
71868-53-6 [RN]
Dipropanoate de (11β,16α)-11-hydroxy-16-méthyl-3,20-dioxoprégna-1,4-diène-17,21-diyle [French] [ACD/IUPAC Name]
Pregna-1,4-diene-3,20-dione, 11-hydroxy-16-methyl-17,21-bis(1-oxopropoxy)-, (11β,16α)- [ACD/Index Name]
[2-[(8S,9S,10R,11S,13S,14S,16R,17R)-11-hydroxy-10,13,16-trimethyl-3-oxo-17-propanoyloxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate
DECHLOROALCLOMETASONE DIPROPIONATE

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

1EE90N4Z0S [DBID]
UNII:1EE90N4Z0S [DBID]
UNII-1EE90N4Z0S [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 605.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.9 mmHg at 25°C
Enthalpy of Vaporization: 103.3±6.0 kJ/mol
Flash Point: 194.2±25.0 °C
Index of Refraction: 1.557
Molar Refractivity: 128.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.54
ACD/LogD (pH 5.5): 3.93
ACD/BCF (pH 5.5): 573.59
ACD/KOC (pH 5.5): 3282.54
ACD/LogD (pH 7.4): 3.93
ACD/BCF (pH 7.4): 573.59
ACD/KOC (pH 7.4): 3282.54
Polar Surface Area: 107 Å2
Polarizability: 50.9±0.5 10-24cm3
Surface Tension: 50.1±5.0 dyne/cm
Molar Volume: 399.3±5.0 cm3

Click to predict properties on the Chemicalize site


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