Found 1 result

Search term: 86401-80-1 (Found by approved synonym)
ChemSpider 2D Image | 16-alpha-Hydroxyprednisolone-21-Acetate | C23H30O7

16-α-Hydroxyprednisolone-21-Acetate

  • Molecular FormulaC23H30O7
  • Average mass418.480 Da
  • Monoisotopic mass418.199158 Da
  • ChemSpider ID18784001

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(11β,16α)-11,16,17-Trihydroxy-3,20-dioxopregna-1,4-dien-21-yl acetate [ACD/IUPAC Name]
(11β,16α)-11,16,17-Trihydroxy-3,20-dioxopregna-1,4-dien-21-yl-acetat [German] [ACD/IUPAC Name]
16-α-Hydroxyprednisolone-21-Acetate
86401-80-1 [RN]
Acétate de (11β,16α)-11,16,17-trihydroxy-3,20-dioxoprégna-1,4-dién-21-yle [French] [ACD/IUPAC Name]
Pregna-1,4-diene-3,20-dione, 21-(acetyloxy)-11,16,17-trihydroxy-, (11β,16α)- [ACD/Index Name]
16A-HYDROXY-PREDNISONLONEACETATE
16α-HYDROPREDNISOLONE ACETATE
16α-Hydroxyprednisonlone acetate
2-[(1S,2R,3aS,3bS,9aR,9bS,10S,11aS)-1,2,10-trihydroxy-9a,11a-dimethyl-7-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-oxoethyl acetate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 599.4±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.9 mmHg at 25°C
    Enthalpy of Vaporization: 102.4±6.0 kJ/mol
    Flash Point: 204.9±23.6 °C
    Index of Refraction: 1.603
    Molar Refractivity: 106.6±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 3
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.04
    ACD/LogD (pH 5.5): 1.59
    ACD/BCF (pH 5.5): 9.48
    ACD/KOC (pH 5.5): 174.18
    ACD/LogD (pH 7.4): 1.59
    ACD/BCF (pH 7.4): 9.48
    ACD/KOC (pH 7.4): 174.17
    Polar Surface Area: 121 Å2
    Polarizability: 42.3±0.5 10-24cm3
    Surface Tension: 61.8±5.0 dyne/cm
    Molar Volume: 310.5±5.0 cm3

    Click to predict properties on the Chemicalize site


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