Identifikatoren & physikalische Daten
| CAS No. | 71808-49-6 |
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| Summenformel | C11H22O |
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| Durchschnittliche Molmasse | 170,29 g/mol |
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| Monoisotopische Masse | 170,16706532 g/mol |
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| SMILES | CCCCCC(=O)CCCCC |
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| InChIKey | ZPQAKYPOZRXKFA-UHFFFAOYSA-N |
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| PubChem CID | 13561 |
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| ChEBI | CHEBI:165748 |
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| EC No. | 213-150-9 |
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| DTXSID | DTXSID5061295 |
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Chemische & physikalische Eigenschaften
| XLogP | 3,8 |
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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 | 8 |
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| Schwere Atome | 12 |
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| Formalladung | 0 |
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| Komplexität | 95,6 |
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| Lipide | Fatty Acyls [FA] -> Oxygenated hydrocarbons [FA12] |
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| SpringerMaterials Properties | Boiling point |
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| Lebensmittelzusatzstoffe | FLAVORING AGENT OR ADJUVANT -> FDA Substance added to food |
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| Dichte | 0.826-0.836 |
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| Aromastoffe | EU Flavoring substances |
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| Löslichkeit | 0.05 mg/mL at 25 °Cinsoluble in watersoluble in fats and non-polar solventsMiscible at room temperature (in ethanol) |
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| Siedepunkt | 228.00 °C. @ 760.00 mm Hg228 °C |
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| Schmelzpunkt | 14 - 15 °C |
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| Brechungsindex | 1.424-1.430 |
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| Physical Description | LiquidColourless white liquid |
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| EPA chemische Informationen | Ketones, C11 (71808-49-6) |
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Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 100% (6 of 6) of all reports.Not ClassifiedAggregated GHS information provided per 6 reports by companies from 1 notifications to the ECHA C&L Inventory.WarningH227: Combustible liquid [Warning Flammable liquids]P210, P280, P370+P378, P403, and P501 (click each P-code to see the statement) |
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| Regulatorische Informationen | Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012) |
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| Hazard Classes and Categories | Not ClassifiedFlammable liquids - Category 4 |
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| TSCA-Inventar-Status | TSCA listed |
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