Diflorasone

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Properties Simple | Detailed

Formula C26H32F2O7
IUPAC Name [2-[(6s,8s,9r,10s,11s,13s,14s,16s,17r)-17-acetoxy-6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxo-ethyl] acetate
Molecular Mass 494.525 g·mol−1
Heat of Formation -1653.1 ± 16.7 kJ·mol−1
Dipole Moment 5.83 ± 1.08 D
Volume 564.79 Å 3
Surface Area 417.34 Å 2
HOMO Energy -9.89 ± 0.55 eV
LUMO Energy -0.54 ± eV
Point Group Symmetry C1
Synonyms
  • 6alpha,9-difluoro-11beta,17,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione 17,21-diacetate
  • 6alpha-fluorobetamethasone-17,21 diacetate
  • [(6s,8s,9r,10s,11s,13s,14s,16s,17r)-17-(2-acetoxyacetyl)-6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] acetate
  • [(6s,8s,9r,10s,11s,13s,14s,16s,17r)-17-(2-acetyloxyacetyl)-6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] acetate
  • [(6s,8s,9r,10s,11s,13s,14s,16s,17r)-17-(2-acetyloxyethanoyl)-6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] ethanoate
  • acetic acid [(6s,8s,9r,10s,11s,13s,14s,16s,17r)-17-(2-acetoxyacetyl)-6,9-difluoro-11-hydroxy-3-keto-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] ester
  • bpbio1_000614
  • d01327
  • diflorasone di(acetate)
  • diflorasone diacetate
  • diflorasone diacetate (jan/usp)
  • pregna-1,4-diene-3,20-dione, 17,21-bis(acetyloxy)-6,9-difluoro-11-hydroxy-16-methyl-, (6alpha,11beta,16beta)-
  • psorcon
  • u 34865
CAS Number(s)
  • 33564-31-7
InChIKey BOBLHFUVNSFZPJ-JOYXJVLSSA-N
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