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Didecyl-dimethyl-ammoniumchlorid
DIDECYLDIMONIUM CHLORIDE · DIDECYL-DIMETHYLAMMONIUM CHLORIDE · quaternium 12 · Didecildimethylammonium chloride · didecyl dimethyl Ammonium Chloride 50% solution in Toluene · btc1010 · bardac22 · btco1010
Identifikatoren & physikalische Daten
| CAS No. | 7173-51-5 |
|---|---|
| Summenformel | C22H48ClN |
| Durchschnittliche Molmasse | 362,1 g/mol |
| Monoisotopische Masse | 361,3475282 g/mol |
| SMILES | CCCCCCCCCC[N+](C)(C)CCCCCCCCCC.[Cl-] |
| InChIKey | RUPBZQFQVRMKDG-UHFFFAOYSA-M |
| PubChem CID | 23558 |
| ChEMBL | CHEMBL224987 |
| ChEBI | CHEBI:79935 |
| EC No. | 230-525-2 |
| DTXSID | DTXSID9032537 |
| Lokaler Name | Didecyl-dimethyl-ammoniumchlorid |
Chemische & physikalische Eigenschaften
| Polarare Oberfläche (TPSA) | 0 |
|---|---|
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 18 |
| Schwere Atome | 24 |
| Formalladung | 0 |
| Komplexität | 200 |
| Schmelzpunkt | 88 °C |
| Siedepunkt | 88°C/1013hPa |
| Dichte | 0.87[at 20℃] |
| Dampfdruck | 0.006Pa at 25℃ |
| Lagerbedingungen | Store below +30°C. |
| Löslichkeit | 248g/L in organic solvents at 20 ℃650mg/L at 25℃ |
| Aggregatzustand | Gel |
| Farbe | Light Beige to Brown |
| pH | 6.5-8.0 (20°C, 10g/L in H2O) |
| Stabilität | Hygroscopic |
| Hauptanwendungen | clinical testing |
| Kosmetik-Inhaltsstoffe Funktionen | ANTISTATICSURFACTANT - CLEANSINGHAIR CONDITIONINGSURFACTANT - EMULSIFYING |
| InChI | InChI=1S/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2/h5-22H2,1-4H31H/q+1/p-1 |
| InChIKey | RUPBZQFQVRMKDG-UHFFFAOYSA-M |
| SMILES | C(CCCCCCCCC)[N+](C)(C)CCCCCCCCCC.[Cl-] |
| LogP (Verteilungskoeffizient) | 2.8 at 20℃ |
| CAS Datenbank | 7173-51-5(CAS DataBase Reference) |
| EPA chemische Informationen | Didecyl dimethyl ammonium chloride (7173-51-5) |
Sicherheit & Vorschriften
| Wassergefährdungsklasse (WGK) | WGK 2 |
|---|---|
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | 2811 |
| R-Sätze (R) | 22-34 |
| Toxizität | LD50 oral in rat: 84mg/kg |
| Gefahrensymbole | C |
| Sicherheitshinweise (S) | 26-36/37/39-45 |
| Gefahrenklasse | 6.1(b)Acute Tox. 4 OralAquatic Chronic 1Eye Dam. 1Skin Corr. 1B |
| Verpackungsgruppe | III |
| Lagerklasse | 8A - Combustible corrosive hazardous materials |
| Gefahrstoffdaten | 7173-51-5(Hazardous Substances Data) |
Anwendungen & Verwendung
Beschreibung
Didecyldimethylammonium chloride is a quaternary ammonium compound used as detergent/disinfectant in hospitals, as algicide in swimming pools, and as a fungicide and against termites in wood. This compound caused contact dermatitis in a hospital employee, also sensitive to glyoxal and bis-(aminopropyl)- laurylamine.