Identifikatoren & physikalische Daten
| CAS No. | 60444-92-0 |
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| Summenformel | C11H15NO2 |
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| Durchschnittliche Molmasse | 193,24 g/mol |
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| Monoisotopische Masse | 193,11027872 g/mol |
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| SMILES | CCCCOc1ccccc1C(N)=O |
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| InChIKey | VPTQXJGFCHOGAN-UHFFFAOYSA-N |
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| PubChem CID | 43269 |
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| EC No. | 654-325-3 |
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| DTXSID | DTXSID10209188 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,1 |
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| Polarare Oberfläche (TPSA) | 52,3 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 5 |
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| Schwere Atome | 14 |
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| Formalladung | 0 |
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| Komplexität | 182 |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, 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 | Acute Tox. 4 (100%) |
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