Identifikatoren & physikalische Daten
| CAS No. | 454479-22-2 |
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| Summenformel | C14H12FNO2S |
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| Durchschnittliche Molmasse | 277,32 g/mol |
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| SMILES | O=S(=O)(/C=C/c1ccccc1)Nc1ccc(F)cc1 |
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| InChIKey | XMABHOFNENDQOQ-ZHACJKMWSA-N |
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| PubChem CID | 730266 |
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| ChEMBL | CHEMBL1546215 |
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| EC No. | 108-853-1 |
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Chemische & physikalische Eigenschaften
| XLogP | 3 |
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| Polarare Oberfläche (TPSA) | 54,6 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 4 |
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| Frei drehbare Bindungen | 4 |
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| Schwere Atome | 19 |
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| Formalladung | 0 |
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| Komplexität | 388 |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Acute Tox. 4 (100%) |
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