(16β)-21-Chloro-9-Fluoro-16-Methyl-3,11,20-Trioxopregna-1,4-Dien-17-Yl Butyrate

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Properties Simple | Detailed

Formula C25H20ClFO5
IUPAC Name (4as,9z)-1-(5-chloro-2-methylene-3,4-dioxo-pentyl)-4a-fluoro-2,5-dimethylene-6,7-didehydro-1h-benzo[10]annulene-4,8-dione; prop-1-yn-1-ol
Molecular Mass 454.875 g·mol−1
Heat of Formation -1140.6 ± 16.7 kJ·mol−1
Dipole Moment 5.20 ± 1.08 D
Volume 554.08 Å 3
Surface Area 419.38 Å 2
HOMO Energy -9.84 ± 0.55 eV
LUMO Energy 2.52 ± eV
Point Group Symmetry C1
Synonyms
  • 21-chloro-9-fluoro-17-hydroxy-16-beta-methylpregna-1,4-diene,3,11,20-trione butyrate
  • 21-chloro-9-fluoro-17-hydroxy-16-methylpregna-1,4-diene-3,11,20-trione 17-butyrate
  • 21-chloro-9-fluoro-17-hydroxy-16beta-methylpregna-1,4-diene-3,11,20-trione 17-butyrate
  • 21-chloro-9-fluoro-17-hydroxy-16beta-methylpregna-1,4-diene-3,11,20-trione butyrate
  • [(8s,9r,10s,13s,14s,16s,17r)-17-(2-chloroacetyl)-9-fluoro-10,13,16-trimethyl-3,11-dioxo-7,8,12,14,15,16-hexahydro-6h-cyclopenta[a]phenanthren-17-yl] butanoate
  • [(8s,9r,10s,13s,14s,16s,17r)-17-(2-chloroethanoyl)-9-fluoro-10,13,16-trimethyl-3,11-dioxo-7,8,12,14,15,16-hexahydro-6h-cyclopenta[a]phenanthren-17-yl] butanoate
  • butanoic acid [(8s,9r,10s,13s,14s,16s,17r)-17-(2-chloro-1-oxoethyl)-9-fluoro-10,13,16-trimethyl-3,11-dioxo-7,8,12,14,15,16-hexahydro-6h-cyclopenta[a]phenanthren-17-yl] ester
  • butyric acid [(8s,9r,10s,13s,14s,16s,17r)-17-(2-chloroacetyl)-9-fluoro-3,11-diketo-10,13,16-trimethyl-7,8,12,14,15,16-hexahydro-6h-cyclopenta[a]phenanthren-17-yl] ester
  • cci 5537
  • clobetasone 17-butyrate
  • clobetasone butyrate
  • clobetasone butyrate (jan/usan)
  • d01273
  • eumovate
  • gr 2/1214
  • kindavate
  • molivate
  • pregna-1,4-diene-3,11,20-trione, 21-chloro-9-fluoro-16-methyl-17-(1-oxobutoxy)-, (16-beta)-
  • pregna-1,4-diene-3,11,20-trione, 21-chloro-9-fluoro-16-methyl-17-(1-oxobutoxy)-, (16beta)-
  • pregna-1,4-diene-3,11,20-trione, 21-chloro-9-fluoro-17-hydroxy-16-beta-methyl-, butyrate
  • sn 203
CAS Number(s)
  • 25122-57-0
InChIKey FBRAWBYQGRLCEK-AVVSTMBFSA-N
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