Identifikatoren & physikalische Daten
| CAS No. | 815-24-7 |
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| Summenformel | C9H18O |
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| Durchschnittliche Molmasse | 142,24 g/mol |
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| Monoisotopische Masse | 142,1357652 g/mol |
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| SMILES | CC(C)(C)C(=O)C(C)(C)C |
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| InChIKey | UIQGEWJEWJMQSL-UHFFFAOYSA-N |
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| PubChem CID | 13152 |
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| EC No. | 212-419-8 |
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| DTXSID | DTXSID1061154 |
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Chemische & physikalische Eigenschaften
| XLogP | 3 |
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| Polarare Oberfläche (TPSA) | 17,1 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 1 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 10 |
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| Formalladung | 0 |
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| Komplexität | 116 |
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| SpringerMaterials Properties | Schoenflies notation |
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| LogP (Verteilungskoeffizient) | 3.0 |
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| Schmelzpunkt | -25.2 °C |
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| Siedepunkt | 152 °C |
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| Dichte | 0.8776 g/cm3 |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH226 (100%): Flammable liquid and vapor [Warning Flammable liquids]P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 46 reports by companies from 3 notifications to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Flam. Liq. 3 (100%) |
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