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Tetrabutylammoniumacetat
TETRA-N-BUTYLAMMONIUM ACETATE · etrabutylammonium acetate · [B4N]Ac · TETRABUTYLAMMON · TETRABUTYLAMINE ACETATE · Tetrabutylaminium·acetate · TETRABUTYLAMMONIUM ACETATE · tetrabutylammomium acetate
Identifikatoren & physikalische Daten
| CAS No. | 10534-59-5 |
|---|---|
| Summenformel | C18H39NO2 |
| Durchschnittliche Molmasse | 301,5 g/mol |
| Monoisotopische Masse | 301,29807949 g/mol |
| SMILES | CC(=O)[O-].CCCC[N+](CCCC)(CCCC)CCCC |
| InChIKey | MCZDHTKJGDCTAE-UHFFFAOYSA-M |
| PubChem CID | 82707 |
| ChEMBL | CHEMBL1079205 |
| EC No. | 234-101-8 |
| DTXSID | DTXSID8065111 |
| Lokaler Name | Tetrabutylammoniumacetat |
Chemische & physikalische Eigenschaften
| Polarare Oberfläche (TPSA) | 40,1 |
|---|---|
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 12 |
| Schwere Atome | 21 |
| Formalladung | 0 |
| Komplexität | 142 |
| Stoffklassen | Nitrogen Compounds -> Quaternary Amines |
| Physical Description | White hygroscopic crystals[Alfa Aesar MSDS] |
| Schmelzpunkt | 95-98 °C (lit.) |
| Siedepunkt | 100 °C |
| Dichte | 0.99 g/mL at 25 °C |
| Brechungsindex | n20/D 1.389 |
| Flammpunkt | 100°C |
| Lagerbedingungen | Inert atmosphere,Room Temperature |
| Löslichkeit | acetonitrile: 0.1 g/mL, clear, colorless to very faint brown |
| Aggregatzustand | Crystalline |
| Farbe | White |
| BRN | 3599376 |
| Stabilität | Hygroscopic |
| InChI | 1S/C16H36N.C2H4O2/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-41-2(3)4/h5-16H2,1-4H31H3,(H,3,4)/q+1/p-1 |
| InChIKey | MCZDHTKJGDCTAE-UHFFFAOYSA-M |
| SMILES | CC([O-])=O.CCCC[N+](CCCC)(CCCC)CCCC |
| CAS Datenbank | 10534-59-5(CAS DataBase Reference) |
| EPA chemische Informationen | 1-Butanaminium, N,N,N-tributyl-, acetate (10534-59-5) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 56 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Status: No longer Valid Update: 08-06-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/266181-Butanaminium, N,N,N-tributyl-, acetate: Does not have an individual approval but may be used under an appropriate group standard |
| Gefahrenübersicht | A skin, respiratory tract, and strong eye irritant[Alfa Aesar MSDS] |
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| F | 3-10 |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 29239000 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| Sicherheitshinweise (S) | 26 |
| Lagerklasse | 11 - Combustible Solids |
| Gefahrenklasse | Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
Anwendungen & Verwendung
Verwenden
Tetrabutylammonium Acetate acts as a catalyst in organic syntheses of anion sensors.