Identifikatoren & physikalische Daten
| CAS No. | 13114-76-6 |
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| Summenformel | C15H16N2O |
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| Durchschnittliche Molmasse | 240,3 g/mol |
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| Monoisotopische Masse | 240,12626314 g/mol |
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| SMILES | Cc1cccc(NC(=O)Nc2ccccc2)c1C |
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| InChIKey | HJFLYCQWMZVXGN-UHFFFAOYSA-N |
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| PubChem CID | 295049 |
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| ChEMBL | CHEMBL465228 |
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| EC No. | 662-731-7 |
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| DTXSID | DTXSID10304102 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,7 |
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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 | 2 |
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| Schwere Atome | 18 |
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| Formalladung | 0 |
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| Komplexität | 274 |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]P264+P265, P273, P280, P305+P351+P338, P337+P317, 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 | Eye Irrit. 2 (100%) |
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