Fluocinolone acetonide 21-thiol

Base Information

• Chemical Name: Fluocinolone acetonide 21-thiol
• CAS No.: 119137-99-4
• Molecular Formula: C₂₄H₃₀F₂O₅S
• Molecular Weight: 468.562
• UNII: PA5L6373PX
• Mol file: 119137-99-4.mol

Synonyms:Fluocinolone acetonide 21-thiol;UNII-PA5L6373PX;PA5L6373PX;119137-99-4;6a,9a-Difluoro-11b,16a,17a-trihydroxy-21-mercapto-pregna-1,4-diene-3,20-dione 16,17-acetonide;Pregna-1,4-diene-3,20-dione, 6,9-difluoro-11-hydroxy-21-mercapto-16,17-((1-methylethylidene)bis(oxy))-, (6alpha,11beta,16alpha)-;SCHEMBL8205284;Q27286430;PREGNA-1,4-DIENE-3,20-DIONE, 6,9-DIFLUORO-11-HYDROXY-21-MERCAPTO-16,17-((1-METHYLETHYLIDENE)BIS(OXY))-, (6.ALPHA.,11.BETA.,16.ALPHA.)-

Chemical Property of Fluocinolone acetonide 21-thiol

Chemical Property:

• XLogP3: 3.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 2
• Exact Mass: 468.17820155
• Heavy Atom Count: 32
• Complexity: 964

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1(OC2CC3C4CC(C5=CC(=O)C=CC5(C4(C(CC3(C2(O1)C(=O)CS)C)O)F)C)F)C
• Isomeric SMILES: C[C@]12C[C@@H]([C@]3([C@H]([C@@H]1C[C@@H]4[C@]2(OC(O4)(C)C)C(=O)CS)C[C@@H](C5=CC(=O)C=C[C@@]53C)F)F)O