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Dodecyltrimethylammoniumbromid
DTAB · 1231 · N,N,N-TRIMETHYL-1-DODECANAMINIUM BROMIDE · LAURTRIMONIUM BROMIDE · 1232 · CetrimideSubstitute · LAURYLTRIMETHYLAMMONIUM BROMIDE · Dodecayltrimethylaminiumbromide

Identifikatoren & physikalische Daten
| CAS No. | 1119-94-4 |
|---|---|
| Summenformel | C15H34N.Br |
| Durchschnittliche Molmasse | 308,34 g/mol |
| SMILES | CCCCCCCCCCCC[N+](C)(C)C.[Br-] |
| InChIKey | XJWSAJYUBXQQDR-UHFFFAOYSA-M |
| PubChem CID | 14249 |
| ChEMBL | CHEMBL109873 |
| ChEBI | CHEBI:282662 |
| EC No. | 214-290-3 |
| DTXSID | DTXSID5044366 |
| Lokaler Name | Dodecyltrimethylammoniumbromid |
Chemische & physikalische Eigenschaften
| Polarare Oberfläche (TPSA) | 0 |
|---|---|
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 11 |
| Schwere Atome | 17 |
| Formalladung | 0 |
| Komplexität | 135 |
| Stoffklassen | Nitrogen Compounds -> Quaternary Amines |
| Kosmetika | Cosmetic ingredients (Laurtrimonium Bromide) -> CIR (Cosmetic Ingredient Review)Hair conditioningAntistaticPreservative |
| Physical Description | Dry PowderWhite to light yellow odorless powderHygroscopic[Acros Organics MSDS] |
| Schmelzpunkt | 246 °C (dec.)(lit.) |
| Dichte | 1.1566 (rough estimate) |
| Dampfdruck | 0Pa at 20℃ |
| Brechungsindex | 1.5260 (estimate) |
| Flammpunkt | 246°C |
| Lagerbedingungen | Store below +30°C. |
| Löslichkeit | H2O: 0.1 M at 20 °C, clear, colorlesssoluble |
| Aggregatzustand | Powder |
| Farbe | White to slightly yellow |
| Biologische Quelle | synthetic (oragnic) |
| BRN | 3597463 |
| Hauptanwendungen | microbiology |
| Kosmetik-Inhaltsstoffe Funktionen | HAIR CONDITIONINGPRESERVATIVE |
| InChI | 1S/C15H34N.BrH/c1-5-6-7-8-9-10-11-12-13-14-15-16(2,3)4/h5-15H2,1-4H31H/q+1/p-1 |
| InChIKey | XJWSAJYUBXQQDR-UHFFFAOYSA-M |
| SMILES | [Br-].CCCCCCCCCCCC[N+](C)(C)C |
| CAS Datenbank | 1119-94-4(CAS DataBase Reference) |
| EPA chemische Informationen | 1-Dodecanaminium, N,N,N-trimethyl-, bromide (1119-94-4) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 2.2% (2 of 89) of reports.DangerH301 (20.2%): Toxic if swallowed [Danger Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 89 reports by companies from 18 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Chemical: 1-Dodecanaminium, N,N,N-trimethyl-, bromide1-Dodecanaminium, N,N,N-trimethyl-, bromide (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Dodecanaminium, N,N,N-trimethyl-, bromide (1:1) are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)REACH registered substance: Dodecyltrimethylammonium bromide (EC: 214-290-3)1-Dodecanaminium, N,N,N-trimethyl-, bromide: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right. |
| Weitere Sicherheitsinformationen | IMAP assessments - Mono- and di-alkyl quaternary ammonium surfactants: Environment tier II assessment |
| Gefahrenübersicht | Causes somnolence and dermatitis in dermal lethal-dose studies of rabbitsCauses other changes in lungs, thorax, or respiration in intravenous lethal-dose studies of mice and rats[RTECS] Oral LD50 (rat) = 200-1,000 mg/kgAn irritant that may cause serious eye injuryHarmful by ingestion, inhalation, and skin absorption[Acros Organics MSDS] |
| Hazard Classes and Categories | Acute Tox. 3 (20.2%)Acute toxicity - category 4Acute toxicity (Oral) - Category 3 |
| Toxizitätsübersicht | The CIR Expert Panel concluded the following ingredients are safe in the present practices of use and concentration described in the safety assessment when formulated to be non-irritating...Laurtrimonium Bromide...Safe for use in cosmetics, with qualifications |
| F | 3-10 |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | UN3077 |
| Zollcode | 29239000 |
| RTECS-Nr. | BQ3195000 |
| R-Sätze (R) | 36/37/38-22-50/53 |
| Toxizität | LD50 orally in Rabbit: 200 - 1000 mg/kg |
| Gefahrensymbole | Xi,Xn,N |
| Sicherheitshinweise (S) | 26-36-37/39-61-60 |
| Gefahrenklasse | 9Acute Tox. 3 OralAquatic Acute 1Aquatic Chronic 1Eye Irrit. 2Skin Irrit. 2 |
| Verpackungsgruppe | III |
| Lagerklasse | 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects |
Anwendungen & Verwendung
Verwenden
Dodecyltrimethylammonium Bromide is a quaternary ammonium salt useful as paint strippers, foaming stabilizers, and bactericidal lotions.