Identifikatoren & physikalische Daten
| CAS No. | 123465-35-0 |
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| Summenformel | C42H80NO8P |
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| Durchschnittliche Molmasse | 758,1 g/mol |
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| Monoisotopische Masse | 757,56215515 g/mol |
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| SMILES | CCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C |
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| InChIKey | JLPULHDHAOZNQI-ZTIMHPMXSA-N |
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| PubChem CID | 5287971 |
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| ChEBI | CHEBI:73002 |
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| EC No. | 306-547-4 |
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| DTXSID | DTXSID301334203 |
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Chemische & physikalische Eigenschaften
| XLogP | 12,9 |
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| Polarare Oberfläche (TPSA) | 111 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 8 |
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| Frei drehbare Bindungen | 40 |
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| Schwere Atome | 52 |
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| Formalladung | 0 |
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| Komplexität | 940 |
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| Stoffklassen | Biological Agents -> Plant Oils and Extracts |
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| Lipide | Lipids -> Ambiguous LipidsLipids -> Glycerophospholipids [GP] -> Glycerophosphocholines [GP01] -> Diacylglycerophosphocholines [GP0101] |
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| Physical Description | Solid |
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| Collision Cross Section | 292.2 Ų [M+CH3COO]- [CCS Type: DTBuffer gas: N2Sample Type: Human bronchoalveolar lavage fluid (BALF)Dataset: Ambiguous Lipids] |
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| Kosmetik-Inhaltsstoffe Funktionen | SKIN CONDITIONING |
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Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 100% (36 of 36) of all reports.Not ClassifiedAggregated GHS information provided per 36 reports by companies from 1 notifications to the ECHA C&L Inventory. |
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| Gefahrenübersicht | See Lecithin. |
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| Hazard Classes and Categories | Not Classified |
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