Identifikatoren & physikalische Daten
| CAS No. | 29771-70-8 |
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| Summenformel | C16H16Cl2N2O |
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| Durchschnittliche Molmasse | 323,2 g/mol |
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| Monoisotopische Masse | 322,0639685 g/mol |
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| SMILES | CC(C)c1ccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)cc1 |
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| InChIKey | OVKTVOZVCAFCDU-UHFFFAOYSA-N |
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| PubChem CID | 768108 |
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| EC No. | 683-773-2 |
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| DTXSID | DTXSID20354299 |
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Chemische & physikalische Eigenschaften
| XLogP | 5,8 |
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| Polarare Oberfläche (TPSA) | 41,1 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 1 |
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| Frei drehbare Bindungen | 3 |
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| Schwere Atome | 21 |
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| Formalladung | 0 |
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| Komplexität | 343 |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]P273, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Aquatic Acute 1 (100%) |
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