Betamethasone acibutate

Base Information

• Chemical Name: Betamethasone acibutate
• CAS No.: 5534-05-4
• Molecular Formula: C28H37FO7
• Molecular Weight: 504.596
• European Community (EC) Number: 226-885-5
• UNII: 90I96070LY
• DSSTox Substance ID: DTXSID3022669
• Nikkaji Number: J7.991J
• Wikidata: Q27122245
• NCI Thesaurus Code: C74405
• Metabolomics Workbench ID: 57561
• ChEMBL ID: CHEMBL1697784
• Mol file: 5534-05-4.mol

Synonyms:Betamethasone acibutate;5534-05-4;Betamethasoni acibutas;Acibutato de betametasona;Acibutate de betamethasone;9-Fluoro-11beta,17,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione 21-acetate 17-isobutyrate;CHEBI:50894;90I96070LY;21-acetoxy-9-fluoro-11beta-hydroxy-16beta-methyl-3,20-dioxopregna-1,4-dien-17-yl 2-methylpropanoate;Acibutate de betamethasone [INN-French];CHEMBL1697784;DTXSID3022669;UNII-90I96070LY;Betamethasone acibutate [INN:BAN];Betamethasoni acibutas [INN-Latin];EINECS 226-885-5;BETAMETHASONE ACIBUTATE [INN];AKOS040740726;Acibutato de betametasona [INN-Spanish];[(8S,9R,10S,11S,13S,14S,16S,17R)-17-(2-acetyloxyacetyl)-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] 2-methylpropanoate;GR 2/541;HY-121062;CS-0079400;Q27122245;(11beta,16beta)-21-(acetyloxy)-9-fluoro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl 2-methylpropanoate;9-FLUORO-11.BETA.,17,21-TRIHYDROXY-16.BETA.-METHYLPREGNA-1,4-DIENE-3,20-DIONE 21-ACETATE 17-ISOBUTYRATE;9-Fluoro-11beta,17,21-trihydroxy-16beta-methylpregnpa-1,4-diene-3,20-dione 21-acetate 17-isobutyrate

Chemical Property of Betamethasone acibutate

Chemical Property:

• Vapor Pressure: 7.65E-17mmHg at 25°C
• Boiling Point: 598.9°C at 760 mmHg
• Flash Point: 316°C
• PSA: 106.97000
• Density: 1.24g/cm³
• LogP: 3.67340
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 504.25233168
• Heavy Atom Count: 36
• Complexity: 1060

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COC(=O)C)OC(=O)C(C)C)C)O)F)C
• Isomeric SMILES: C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)COC(=O)C)OC(=O)C(C)C)C)O)F)C
• Recent EU Clinical Trials: Patients with rheumatoid arthritis and synovitis treated with ultrasound guided intraarticular or intramuscular glucocorticoid injection - A randomised, double-blind, controlled study (Panguian)

Technology Process of Betamethasone acibutate

There total 1 articles about Betamethasone acibutate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ betamethasone acibutate (5534-05-4)

Guidance literature: