ChemSpider 2D Image | prednisolone steaglate | C41H64O8

prednisolone steaglate

  • Molecular FormulaC41H64O8
  • Average mass684.942 Da
  • Monoisotopic mass684.460144 Da
  • ChemSpider ID64342

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(11b)-11,17-Dihydroxy-21-[[[(1-oxooctadecyl)oxy]acetyl]oxy]pregna-1,4-diene-3,20-dione
(11β)-11,17-Dihydroxy-21-[[[(1-oxooctadecyl)oxy]acetyl]oxy]pregna-1,4-diene-3,20-dione
2-{[(11β)-11,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl]oxy}-2-oxoethyl octadecanoate
2-{[(11β)-11,17-Dihydroxy-3,20-dioxopregna-1,4-dien-21-yl]oxy}-2-oxoethyl stearate [ACD/IUPAC Name]
2-{[(11β)-11,17-Dihydroxy-3,20-dioxopregna-1,4-dien-21-yl]oxy}-2-oxoethylstearat [German] [ACD/IUPAC Name]
225-763-9 [EINECS]
5060-55-9 [RN]
Erbacort
esteaglato de prednisolona [Spanish] [INN]
Estilsona
More...

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

2071 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 768.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.9 mmHg at 25°C
Enthalpy of Vaporization: 127.7±6.0 kJ/mol
Flash Point: 223.5±26.4 °C
Index of Refraction: 1.542
Molar Refractivity: 190.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 2
ACD/LogP: 11.49
ACD/LogD (pH 5.5): 10.37
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.37
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 127 Å2
Polarizability: 75.4±0.5 10-24cm3
Surface Tension: 49.4±5.0 dyne/cm
Molar Volume: 604.4±5.0 cm3

Click to predict properties on the Chemicalize site


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