Identifikatoren & physikalische Daten
| CAS No. | 203319-65-7 |
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| Summenformel | C8H16 |
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| Durchschnittliche Molmasse | 112,21 g/mol |
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| Monoisotopische Masse | 112,12520051 g/mol |
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| SMILES | C[C@@H]1CCCC[C@H]1C |
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| InChIKey | KVZJLSYJROEPSQ-HTQZYQBOSA-N |
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| PubChem CID | 23313 |
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| ChEBI | CHEBI:188237 |
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| EC No. | 229-979-4 |
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| DTXSID | DTXSID30858753 |
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Chemische & physikalische Eigenschaften
| XLogP | 3,8 |
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| Polarare Oberfläche (TPSA) | 0 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 0 |
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| Frei drehbare Bindungen | 0 |
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| Schwere Atome | 8 |
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| Formalladung | 0 |
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| Komplexität | 56,4 |
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| Lipide | Fatty Acyls [FA] -> Hydrocarbons [FA11] |
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| SpringerMaterials Properties | Optical coefficient |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH224 (11.1%): Extremely flammable liquid and vapor [Danger Flammable liquids]P210, P233, P240, P241, P242, P243, P261, P271, P280, P301+P316, P303+P361+P353, P304+P340, P319, P331, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 54 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Flam. Liq. 1 (11.1%) |
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