Identifikatoren & physikalische Daten
| CAS No. | 302909-51-9 |
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| Summenformel | C14H20ClNO |
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| Durchschnittliche Molmasse | 253,77 g/mol |
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| Monoisotopische Masse | 253,123342 g/mol |
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| SMILES | CCCCCCCNC(=O)c1cccc(Cl)c1 |
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| InChIKey | SCYWBGROYTZINS-UHFFFAOYSA-N |
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| PubChem CID | 3597656 |
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| EC No. | 657-597-1 |
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| DTXSID | DTXSID501377083 |
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Chemische & physikalische Eigenschaften
| XLogP | 3,6 |
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| Polarare Oberfläche (TPSA) | 29,1 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 1 |
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| Frei drehbare Bindungen | 7 |
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| Schwere Atome | 17 |
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| Formalladung | 0 |
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| Komplexität | 220 |
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| Siedepunkt | 377.9±25.0 °C(Predicted) |
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| Dichte | 1.053±0.06 g/cm3(Predicted) |
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| pKa (Säurekonstante) | 14.56±0.46(Predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
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| Alarmwort | Achtung |
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| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H315 |
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