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[4,4,5,5,6,6,7,7,8,8,9,9,10,11,11,11-Hexadecafluor-2-hydroxy-10-(trifluormethyl)undecyl]trimethylammoniumiodid
Einecs 279-621-6 · (4,4,5,5,6,6,7,7,8,8,9,9,10,11,11,11-Hexadecafluoro-2-hydroxy-10-(trifluoromethyl)undecyl)trimethylammonium iodide · [4,4,5,5,6,6,7,7,8,8,9,9,10,11,11,11-hexadecafluoro-2-hydroxy-10-(trifluoromethyl)undecyl]trimethylammonium iodide
![Molekülstruktur von [4,4,5,5,6,6,7,7,8,8,9,9,10,11,11,11-Hexadecafluor-2-hydroxy-10-(trifluormethyl)undecyl]trimethylammoniumiodid](/img/chemical/3018975.png)
Identifikatoren & physikalische Daten
| CAS No. | 80909-29-1 |
|---|---|
| Summenformel | C15H15F19INO |
| Durchschnittliche Molmasse | 713,16 g/mol |
| Monoisotopische Masse | 712,98949828 g/mol |
| SMILES | C[N+](C)(C)CC(O)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(C(F)(F)F)C(F)(F)F.[I-] |
| InChIKey | BPGOAOSBJKHSJL-UHFFFAOYSA-M |
| PubChem CID | 3018975 |
| EC No. | 279-621-6 |
| DTXSID | DTXSID00880985 |
| Lokaler Name | [4,4,5,5,6,6,7,7,8,8,9,9,10,11,11,11-Hexadecafluor-2-hydroxy-10-(trifluormethyl)undecyl]trimethylammoniumiodid |
Chemische & physikalische Eigenschaften
| Polarare Oberfläche (TPSA) | 20,2 |
|---|---|
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 21 |
| Frei drehbare Bindungen | 10 |
| Schwere Atome | 37 |
| Formalladung | 0 |
| Komplexität | 761 |
| PFAS | PFAS -> OECD CategoryPFAS -> Other/unspecified |
| EPA chemische Informationen | 3-(Perfluoro-7-(methyl)octyl)-2-hydroxypropyltrimethylammonium iodide (80909-29-1) |