Cetalkonium

Base Information

• Chemical Name: Cetalkonium
• CAS No.: 10328-34-4
• Deprecated CAS: 21396-54-3,51895-89-7
• Molecular Formula: C25H46 N
• Molecular Weight: 360.647
• UNII: FHG725432Z
• DSSTox Substance ID: DTXSID3047007
• Nikkaji Number: J238.579A
• Wikidata: Q27277991
• NCI Thesaurus Code: C83612
• Metabolomics Workbench ID: 152727
• ChEMBL ID: CHEMBL1624075
• Mol file: 10328-34-4.mol

Synonyms:benzylcetyldimethylammonium;benzylcetyldimethylammonium chloride hydrate;BZK-C16

Chemical Property of Cetalkonium

Chemical Property:

• Melting Point: 54-58℃
• PSA: 0.00000
• LogP: 7.74430
• Water Solubility.: MODERATELY SOLUBLE
• XLogP3: 9.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 17
• Exact Mass: 360.363025472
• Heavy Atom Count: 26
• Complexity: 291

Purity/Quality:

98%,99%, ^*data from raw suppliers

Benzyldimethylhexadecylammoniumchloridehydrate 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R21/22:; R34:; R50:
• Hazard Codes: C:Corrosive;;
• Statements: R21/22:; R34:; R50:
• Safety Statements: S36/37/39:; S45:; S61:

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1
• Therapeutic Function: Antiseptic

Technology Process of Cetalkonium

There total 1 articles about Cetalkonium which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ benzyldimethylhexadecylammonium cation (10328-34-4)

Guidance literature:

Dimethylhexadecylamine, Benzylchloride, Methanol, (90grad, 3 Std.);