HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 4622Erstellt: 25. Oktober 2026
Oxibendazol
FENBENDAZOLE SULFOXIDE · Oxbendazole · obdz · Equitac · SKF-30310 · Oxbidazole · Obendazole · Oxibendazole
https://huagongshe.com/de/chemical/4622
Identifikatoren & physikalische Daten
| CAS No. | 20559-55-1 |
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| Summenformel | C12H15N3O3 |
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| Durchschnittliche Molmasse | 249,27 g/mol |
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| Monoisotopische Masse | 249,11134134 g/mol |
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| SMILES | CCCOc1ccc2nc(NC(=O)OC)[nH]c2c1 |
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| InChIKey | RAOCRURYZCVHMG-UHFFFAOYSA-N |
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| PubChem CID | 4622 |
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| ChEMBL | CHEMBL1087630 |
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| ChEBI | CHEBI:92907 |
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| EC No. | 243-877-7 |
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| DTXSID | DTXSID5045625 |
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| Lokaler Name | Oxibendazol |
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Chemische & physikalische Eigenschaften
| XLogP | 2,4 |
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| Polarare Oberfläche (TPSA) | 76,2 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 4 |
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| Frei drehbare Bindungen | 5 |
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| Schwere Atome | 18 |
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| Formalladung | 0 |
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| Komplexität | 288 |
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| Arzneimittel | Pharmaceuticals -> Listed in ZINC15 |
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| Animal Drugs | FDA approved animal drugs -> Active ingredientPharmaceuticals -> Animal Drugs -> Approved in Taiwan |
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| Collision Cross Section | 156.71 Ų [M+H]+ [CCS Type: TWMethod: calibrated with polyalanine and drug standards]173.5 Ų [M+Na]+ [CCS Type: TWMethod: calibrated with Waters Major Mix]157.5 Ų [M+H]+ [CCS Type: TW |
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| Schmelzpunkt | 230-231°C |
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| Dichte | 1.301±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | 2-8°C |
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| Löslichkeit | DMSO (Slightly, Heated), THF (Slightly, Heated) |
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| pKa (Säurekonstante) | 10.60±0.10(Predicted) |
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| Aggregatzustand | Solid |
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| Farbe | Off-White |
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| Merck | 14,6936 |
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| InChI | 1S/C12H15N3O3/c1-3-6-18-8-4-5-9-10(7-8)14-11(13-9)15-12(16)17-2/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15,16) |
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| InChIKey | RAOCRURYZCVHMG-UHFFFAOYSA-N |
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| SMILES | CCCOc1ccc2[nH]c(NC(=O)OC)nc2c1 |
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| CAS Datenbank | 20559-55-1(CAS DataBase Reference) |
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Sicherheit & Vorschriften
| GHS-Einstufung | Not Classified |
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| Regulatorische Informationen | Oxibendazole: Does not have an individual approval but may be used under an appropriate group standard |
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| Weitere Sicherheitsinformationen | IMAP assessments - Carbamic acid, (5-propoxy-1H-benzimidazol-2-yl)-, methyl ester: Environment tier I assessment |
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| Hazard Classes and Categories | Not Classified |
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| Wassergefährdungsklasse (WGK) | 3 |
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| Zollcode | 29339900 |
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| RTECS-Nr. | FD0835000 |
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| Toxizität | mouse,LDLo,oral,32gm/kg (32000mg/kg),American Journal of Veterinary Research. Vol. 38, Pg. 809, 1977. |
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| Lagerklasse | 11 - Combustible Solids |
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