Methyltri-n-octylammonium Chloride

• Catalog Number: ACM5137553
• Product Name: Methyltri-n-octylammonium Chloride
• CAS: 5137-55-3
• Category: Ammonium Ionic Liquids
• Synonyms: 102055-EP2275469A1; Aliquat 336; UNII-07Q8S2MJ6A; N-Methyl-N,N-dioctyl-1-octanaminium chloride; EINECS 225-896-2; methyl(trioctyl)azanium chloride; 93810-EP2305625A1; methyl trioctylammonium chloride; XKBGEWXEAPTVCK-UHFFFAOYSA-M; NSC 61369
• IUPAC Name: methyl(trioctyl)azanium;chloride
• Molecular Weight: 404.164g/mol
• Molecular Formula: C25H54ClN
• Canonical SMILES: CCCCCCCC[N+](C)(CCCCCCCC)CCCCCCCC.[Cl-]
• InChI: InChI=1S/C25H54N.ClH/c1-5-8-11-14-17-20-23-26(4,24-21-18-15-12-9-6-2)25-22-19-16-13-10-7-3;/h5-25H2,1-4H3;1H/q+1;/p-1
• InChI Key: XKBGEWXEAPTVCK-UHFFFAOYSA-M
• Complexity: 220
• Covalently-Bonded Unit Count: 2
• EC Number: 225-896-2
• Exact Mass: 403.394g/mol
• H-Bond Acceptor: 1
• Heavy Atom Count: 27
• Monoisotopic Mass: 403.394g/mol
• NSC Number: 61369
• Rotatable Bond Count: 21
• Topological Polar Surface Area: 0A^2
• UNII: 07Q8S2MJ6A