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Triamcinolon-16-α,21-di(acetat)
TAC-D · 8357RP · CINO-40 · Tedarol · Cenacort · Tracilon · Kenacourt · 21-diacetate
Identifikatoren & physikalische Daten
| CAS No. | 67-78-7 |
|---|---|
| Summenformel | C25H31FO8 |
| Durchschnittliche Molmasse | 478,5 g/mol |
| Monoisotopische Masse | 478,2002961 g/mol |
| SMILES | CC(=O)OCC(=O)[C@@]1(O)[C@H](OC(C)=O)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C |
| InChIKey | XGMPVBXKDAHORN-RBWIMXSLSA-N |
| PubChem CID | 6216 |
| ChEMBL | CHEMBL1200449 |
| ChEBI | CHEBI:9669 |
| EC No. | 200-669-0 |
| DTXSID | DTXSID0048713 |
| Lokaler Name | Triamcinolon-16-α,21-di(acetat) |
Chemische & physikalische Eigenschaften
| XLogP | 1,9 |
|---|---|
| Polarare Oberfläche (TPSA) | 127 |
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 9 |
| Frei drehbare Bindungen | 6 |
| Schwere Atome | 34 |
| Formalladung | 0 |
| Komplexität | 1.020 |
| LogP (Verteilungskoeffizient) | 1.92 |
| Human Drugs | FDA approved drugs -> Active ingredientPharmaceuticals |
| Collision Cross Section | 209.5 Ų [M+H]+ [CCS Type: TWMethod: calibrated with polyalanine and drug standards] |
| Schmelzpunkt | 186-188 C |
| Siedepunkt | 608.5±55.0 °C(Predicted) |
| Dichte | 1.2087 (estimate) |
| Lagerbedingungen | Refrigerator |
| Löslichkeit | Chloroform (Slightly, Heated), DMSO (Slightly), Methanol (Slightly)48mg/L(25 ºC) |
| pKa (Säurekonstante) | 11.21±0.70(Predicted) |
| Aggregatzustand | Solid |
| Farbe | White |
| CAS Datenbank | 67-78-7(CAS DataBase Reference) |
| NIST chemische Informationen | Triamcinolone diacetate(67-78-7) |
| EPA chemische Informationen | Triamcinolone diacetate (67-78-7) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH301 (25%): Toxic if swallowed [Danger Acute toxicity, oral]P203, P261, P264, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P317, P318, P321, P330, P362+P364, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 4 reports by companies from 3 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, 16,21-bis(acetyloxy)-9-fluoro-11,17-dihydroxy-, (11.beta.,16.alpha.)-: Environment tier I assessment |
| Hazard Classes and Categories | Acute Tox. 4 (25%) |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 2937220000 |
Anwendungen & Verwendung
Verwenden
A glucocorticoid that inhibits prolyl hydroxylase activity, Triamcinolone diacetate can be used as an antiasthmatic and antiallergic drug.