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Iodixanol
OptiPrep · Visipaque · Iothalamate · DU-6807 · Ioxanol · Ioxaxol · odixanol · Acupaque
Identifikatoren & physikalische Daten
| CAS No. | 92339-11-2 |
|---|---|
| Summenformel | C35H44I6N6O15 |
| Durchschnittliche Molmasse | 1.550,2 g/mol |
| Monoisotopische Masse | 1.549,71330271 g/mol |
| SMILES | CC(=O)N(CC(O)CN(C(C)=O)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I |
| InChIKey | NBQNWMBBSKPBAY-UHFFFAOYSA-N |
| PubChem CID | 3724 |
| ChEMBL | CHEMBL1200507 |
| ChEBI | CHEBI:31705 |
| EC No. | 618-837-0 |
| DTXSID | DTXSID2045523 |
Chemische & physikalische Eigenschaften
| XLogP | -3,4 |
|---|---|
| Polarare Oberfläche (TPSA) | 339 |
| H-Brücken-Donoren | 13 |
| H-Brücken-Akzeptoren | 15 |
| Frei drehbare Bindungen | 22 |
| Schwere Atome | 62 |
| Formalladung | 0 |
| Komplexität | 1.330 |
| Arzneimittel | Pharmaceuticals |
| pH | 7.2-7.6 (c = 320 mg I/L) |
| LogP (Verteilungskoeffizient) | 0.5 |
| Dichte | 1.2661.266 ±0.003 |
| Viscosity | 11.1 mPa at 37 °C |
| Löslichkeit | Soluble in water1.85e-01 g/LFreely soluble in water, sparingly soluble in methanol, practically insoluble in methylene chloride. |
| Human Drugs | Breast FeedingLactationMilk, HumanContrast MediaDiagnostic AgentsFDA approved drugs -> Active ingredient |
| Schmelzpunkt | 240-250 °C262-267°C (dec.) |
| Physical Description | Solid |
| Other Experimental Properties | Osmolality 290 mOsm/kg H2O |
| Siedepunkt | 1250.9±65.0 °C(Predicted) |
| Dampfdruck | 0Pa at 20℃ |
| Brechungsindex | n 1.4128 ±0.0003 |
| Lagerbedingungen | Refrigerator |
| pKa (Säurekonstante) | 11.04±0.46(Predicted) |
| Aggregatzustand | liquid |
| Farbe | White |
| Hauptanwendungen | pharmaceutical (small molecule) |
| InChIKey | NBQNWMBBSKPBAY-UHFFFAOYSA-N |
| SMILES | C(N(C1C(I)=C(C(NCC(O)CO)=O)C(I)=C(C(NCC(O)CO)=O)C=1I)C(C)=O)C(O)CN(C1C(I)=C(C(NCC(O)CO)=O)C(I)=C(C(NCC(O)CO)=O)C=1I)C(C)=O |
| LogP (Verteilungskoeffizient) | 0.7 |
| EPA chemische Informationen | 1,3-Benzenedicarboxamide, 5,5'-[(2-hydroxy-1,3-propanediyl)bis(acetylimino)]bis[N,N'-bis(2,3-dihydroxypropyl)-2,4,6-triiodo- (92339-11-2) |
Sicherheit & Vorschriften
| GHS-Einstufung | Not Classified |
|---|---|
| Regulatorische Informationen | Status: Active Update: 19-12-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/7066 |
| FDA-Anforderungen | The Approved Drug Products with Therapeutic Equivalence Evaluations identifies currently marketed prescription drug products, including iodixanol, approved on the basis of safety and effectiveness by FDA under sections 505 of the Federal Food, Drug, and Cosmetic Act. |
| Hazard Classes and Categories | Not Classified |
| Hazardous Reactivities and Incompatibilities | /Investigators sought/ to test the compatibility of trisodium citrate, a catheter lock solution, with iodinated contrast medium. ...Ioxaglate... was tested. In all tests, 2 mL of contrast medium were mixed with 2 mL of trisodium citrate solution. ...Ioxaglate provoked a highly viscous gluelike precipitation when mixed with trisodium citrate. /It was concluded that/one must be aware of the potential for precipitation when contrast medium is mixed with trisodium citrate solution. Before trisodium citrate solution is injected, the catheter should be thoroughly flushed with saline if a contrast medium has previously been injected through it. |
| Brandbekämpfungsverfahren | As with all fires, evacuate personnel to a safe area. Firefighters should use self-contained breathing equipment and protective clothing.Water spray, dry chemical, carbon dioxide, or foam as appropriate for surrounding fire and materials. |
| Lagerbedingungen | Store in tight container ... . This material should be handled and stored per label instructions to ensure product integrity. |
| Reinigungsverfahren | Wear approved respiratory protection, chemically compatible gloves, and protective clothing. Wipe up spillage or collect spillage using a high-efficiency vacuum cleaner. Avoid breathing dust. Place spillage in appropriately labeled container for disposal. Wash spill site. |
| Entsorgungsverfahren | SRP: Expired or waste pharmaceuticals shall carefully take into consideration applicable DEA, EPA, and FDA regulations. It is not appropriate to dispose by flushing the pharmaceutical down the toilet or discarding to trash. If possible return the pharmaceutical to the manufacturer for proper disposal being careful to properly label and securely package the material. Alternatively, the waste pharmaceutical shall be labeled, securely packaged and transported by a state licensed medical waste contractor to dispose by burial in a licensed hazardous or toxic waste landfill or incinerator. |
Anwendungen & Verwendung
Verwenden
Nonionic, dimeric x-ray contrast medium. Diagnostic aid (radiopaque medium).