Methyltrioctylammoniumchlorid
Trioctylmethylammonium chloride
Grundinformationen
- CAS
5137-55-3- Standard-SMILES
CCCCCCCC[N+](C)(CCCCCCCC)CCCCCCCC.[Cl-]- InChIKey
XKBGEWXEAPTVCK-UHFFFAOYSA-M- Summenformel
- C25H54N.Cl
- Durchschnittliche Molmasse
- 404,2 g/mol
- Monoisotopische Masse
- 403,3944784
Überblick
Methyltrioctylammonium chloride is an organic chloride salt having methyltrioctylammonium as the cation. It has a role as a phase-transfer catalyst. It is a quaternary ammonium salt and an organic chloride salt. It contains a methyltrioctylammonium.
Namen und Bezeichner
- Bevorzugter Name
- Trioctylmethylammonium chloride
- IUPAC
- methyl(trioctyl)azanium chloride
- Lokaler Name
- Methyltrioctylammoniumchlorid
- Englischer Name
- Methyl trioctyl ammonium chloride
- Summenformel
- C25H54N.Cl
- Molmasse
- 404.16
Namen und Synonyme
5137-55-3Methyltrioctylammonium chlorideTrioctylmethylammonium chlorideTOMACCapriquatMethyltricaprylylammonium chlorideTricaprylylmethylammonium chlorideTricaprylmethylammonium chlorideTrioctylmonomethylammonium chlorideN-Methyl-N,N-dioctyl-1-octanaminium chlorideDTXSID1044487AMMONIUM, METHYLTRIOCTYL-, CHLORIDE
Weitere Namen anzeigen
ALIQUAT 336aliquatADOGEN 464METHYLTRI-N-OCTYLAMMONIUM CHLORIDE
Tricaprylyl methyl ammonium chlorideAliquat 12807Q8S2MJ6ANSC-61369TOMAC 75DTXCID9024487CHEBI:75286TOMAC salt
Datenbank-Bezeichner
- CAS
5137-55-3- PubChem CID
- 21218
- DTXSID
DTXSID1044487- ChEMBL
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 0 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 21
- Schwere Atome
- 27
- Formalladung
- 0
- Komplexität
- 220
Experimentelle und physikochemische Eigenschaften
Chemical ClassesNitrogen Compounds -> Quaternary Amines
Density0.884 @25 °C
Boiling Point225 °C @760 [mm Hg]
Melting Point-20 °C
Physical DescriptionYellow viscous liquid; [Alfa Aesar MSDS]
Physikochemische Eigenschaften
- Schmelzpunkt
- -20 °C · -20°C
- Siedepunkt
- 240 °C · 240°C
- Dichte
- 0.884 g/mL · 0.884 g/mL at 25 °C(lit.)
- Dampfdruck
- 0 Pa · 0Pa at 25℃
- Brechungsindex
- 20 · n20/D 1.4665(lit.)
- Flammpunkt
- 230 °F · >230 °F
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Löslichkeit
- soluble in Chloroform, Hexanes
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Danger
H301 (79.6%): Toxic if swallowed [Danger Acute toxicity, oral]
P260, P264, P264+P265, P270, P273, P280, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P321, P330, P332+P317, P337+P317, P362+P364, P363, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 191 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: 1-Octanaminium, N-methyl-N,N-dioctyl-, chloride
REACH registered substance: Methyltrioctylammonium chloride (EC: 225-896-2)
Methyltrioctylammonium chloride: Does not have an individual approval but may be used under an appropriate group standard
Hazards Summary
A severe skin irritant; Causes muscle weakness in intraperitoneal lethal-dose studies of guinea pigs, mice, and rats; Causes diarrhea and respiratory depression in oral lethal-dose studies of rats; [RTECS] An irritant that may cause serious eye injury; Harmful by ingestion; [Alfa Aesar MSDS]
Hazard Classes and CategoriesAcute Tox. 3 (79.6%)
Sicherheit und Schutzausrüstung
Protective Action Criteria (PAC)
0.67 [mg/m3]
7.4 [mg/m3]
44 [mg/m3]
Sicherheitsdaten
Chemie und Industrie
Verwendung und Herstellung
UsesPermitted for use as an inert ingredient in non-food pesticide products; [EPA] Used in high performance liquid chromatography for the separation of tRNA. [ChemIDplus]
General Manufacturing Information1-Octanaminium, N-methyl-N,N-dioctyl-, chloride (1:1): ACTIVE
Anwendungen
VerwendenMethyltrioctylammonium chloride can be used:As a catalyst in the synthesis of acridine dione derivatives from aromatic aldehyde, dimedone and amines under ultrasonic irradiations.As a catalyst in the synthesis of extended π-systems using aromatic aldehydes and methyldiazines.As a component of a catalytic system used in the Suzuki-Miyaura cross-coupling reaction of a variety of aryl and heteroaryl chlorides in H2O.
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