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Triamcinolonhexacetonid
Triamcinide caproate · tatba · C08185 · cl34433 · lederspan · aristospan · Hextrianide · Triamcinolone hexatonide
Identifikatoren & physikalische Daten
| CAS No. | 5611-51-8 |
|---|---|
| Summenformel | C30H41FO7 |
| Durchschnittliche Molmasse | 532,6 g/mol |
| Monoisotopische Masse | 532,2836318 g/mol |
| SMILES | CC(C)(C)CC(=O)OCC(=O)[C@@]12OC(C)(C)O[C@@H]1C[C@H]1[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]12C |
| InChIKey | TZIZWYVVGLXXFV-FLRHRWPCSA-N |
| PubChem CID | 21826 |
| ChEMBL | CHEMBL1200878 |
| ChEBI | CHEBI:9670 |
| EC No. | 227-031-4 |
| DTXSID | DTXSID0048634 |
| Lokaler Name | Triamcinolonhexacetonid |
Chemische & physikalische Eigenschaften
| XLogP | 4,8 |
|---|---|
| Polarare Oberfläche (TPSA) | 99,1 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 8 |
| Frei drehbare Bindungen | 6 |
| Schwere Atome | 38 |
| Formalladung | 0 |
| Komplexität | 1.130 |
| Human Drugs | FDA approved drugs -> Active ingredientPharmaceuticalsMedicines for juvenile joint diseases |
| Schmelzpunkt | 295-296° (dec)mp 271-272° (dec) |
| Siedepunkt | 619.5±55.0 °C(Predicted) |
| Dichte | 1.1277 (estimate) |
| Lagerbedingungen | 2-8°C |
| Löslichkeit | Practically insoluble in water, sparingly soluble in anhydrous ethanol and in methanol. |
| pKa (Säurekonstante) | 13.09±0.70(Predicted) |
| Aggregatzustand | Solid |
| Farbe | Fine, white, needle-like crystals |
| Hauptanwendungen | pharmaceuticalpharmaceutical small molecule |
| InChIKey | TZIZWYVVGLXXFV-FLRHRWPCSA-N |
| SMILES | F[C@@]21[C@H]([C@H]4[C@@]([C@@]5(OC(O[C@@H]5C4)(C)C)C(=O)COC(=O)CC(C)(C)C)(C[C@@H]2O)C)CCC3=CC(=O)C=C[C@@]31C |
| EPA chemische Informationen | Triamcinolone hexacetonide (5611-51-8) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (60%): Harmful if swallowed [Warning Acute toxicity, oral]P203, P233, P260, P261, P264, P270, P271, P272, P280, P284, P301+P317, P302+P352, P304+P340, P317, P318, P319, P321, P330, P333+P317, P342+P316, P362+P364, P403, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 5 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Weitere Sicherheitsinformationen | IMAP assessments - Pregna-1,4-diene-3,20-dione, 21-(3,3-dimethyl-1-oxobutoxy)-9-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]-, (11.beta.,16.alpha.)-: Human health tier I assessment |
| Hazard Classes and Categories | Acute Tox. 4 (60%) |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 2937220000 |
| Lagerklasse | 11 - Combustible Solids |
| Gefahrenklasse | Repr. 2 |
Anwendungen & Verwendung
Verwenden
Triamcinolone Hexacetonide is the Intra-articular glucocorticoid treatment for rheumatoid arthritis.