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O,O-Dimethyl-O-p-sulfimoylphenyl-thiophosphat
Proban · CL 26691 · CYTHIOATE · CYFLEE(R) · PROBAN(R) · ent25,640 · ENT 25,640 · NSC 310287
Identifikatoren & physikalische Daten
| CAS No. | 115-93-5 |
|---|---|
| Summenformel | C8H12NO5PS2 |
| Durchschnittliche Molmasse | 297,3 g/mol |
| Monoisotopische Masse | 296,98945183 g/mol |
| SMILES | COP(=S)(OC)Oc1ccc(S(N)(=O)=O)cc1 |
| InChIKey | BSBSDQUZDZXGFN-UHFFFAOYSA-N |
| PubChem CID | 8293 |
| ChEMBL | CHEMBL2104588 |
| EC No. | 204-115-9 |
| DTXSID | DTXSID8041828 |
| Lokaler Name | O,O-Dimethyl-O-p-sulfimoylphenyl-thiophosphat |
Chemische & physikalische Eigenschaften
| XLogP | 1,6 |
|---|---|
| Polarare Oberfläche (TPSA) | 128 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 7 |
| Frei drehbare Bindungen | 5 |
| Schwere Atome | 17 |
| Formalladung | 0 |
| Komplexität | 377 |
| SpringerMaterials Properties | Fusion temperature |
| Animal Drugs | FDA approved animal drugs -> Active ingredient |
| Endocrine Disruptors | Potential endocrine disrupting compound |
| Schmelzpunkt | 70-71° |
| Siedepunkt | 407.7±55.0 °C(Predicted) |
| Dichte | 1.459±0.06 g/cm3(Predicted) |
| Brechungsindex | nD25 1.5346 |
| Lagerbedingungen | 2-8°C |
| Aggregatzustand | Crystalline |
| pKa (Säurekonstante) | 10.04±0.10(Predicted) |
| BRN | 2148114 |
| Hauptanwendungen | agricultureenvironmental |
| InChI | 1S/C8H12NO5PS2/c1-12-15(16,13-2)14-7-3-5-8(6-4-7)17(9,10)11/h3-6H,1-2H3,(H2,9,10,11) |
| InChIKey | BSBSDQUZDZXGFN-UHFFFAOYSA-N |
| SMILES | COP(=S)(OC)Oc1ccc(cc1)S(N)(=O)=O |
| NIST chemische Informationen | Cythioate(115-93-5) |
| EPA chemische Informationen | Cythioate (115-93-5) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. |
|---|---|
| Regulatorische Informationen | Cythioate: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right. |
| Weitere Sicherheitsinformationen | IMAP assessments - Phosphorothioic acid, O-[4-(aminosulfonyl)phenyl] O,O-dimethyl ester: Human health tier I assessment |
| Hazard Classes and Categories | Acute Tox. 3 (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | 2783 |
| Zollcode | 29350090 |
| R-Sätze (R) | 22 |
| Toxizität | LD50 orally in rats: 160 mg/kg (Kenaga, Allison) |
| Gefahrensymbole | Xn |
| Gefahrenklasse | 6.1(b)Acute Tox. 3 Oral |
| Verpackungsgruppe | III |
| Lagerklasse | 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects |
Anwendungen & Verwendung
Beschreibung
Cythioate is a member of the organothiophosphate compounds that is used as an insecticide and anthelmintic. It has been sold under the trade names Cyflee and Proban, under which form it has been used for veterinary purposes against fleas.
Verwenden
Cythioate is used as pesticide.