Benzylhexadecyldimethylammonium chloride
TL;DR: Benzylhexadecyldimethylammonium chloride (CAS 122-18-9) is a chemical compound with molecular formula C25H46ClN and molecular weight 395.33188 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl-hexadecyl-dimethylazanium chloride
Also Known As: Cetalkonium chloride, Cetyl zephiran, Benzyldimethylhexadecylammonium chloride, Banicol, Acinol
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C25H46ClN |
| Molecular Weight | 395.33188 g/mol |
| XLogP | 4.75 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 17 |
| Exact Mass | 395.33188 Da |
| Heavy Atoms | 27 |
| Complexity | 291.0 |
| SMILES | CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-] |
| InChIKey | SXPWTBGAZSPLHA-UHFFFAOYSA-M |
Chemical Property Profile of Benzylhexadecyldimethylammonium chloride
Property Insights of Benzylhexadecyldimethylammonium chloride
The XLogP value of 4.75 indicates that Benzylhexadecyldimethylammonium chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzylhexadecyldimethylammonium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzylhexadecyldimethylammonium chloride has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzylhexadecyldimethylammonium chloride?
The CAS number of Benzylhexadecyldimethylammonium chloride is 122-18-9.
What is the molecular formula of Benzylhexadecyldimethylammonium chloride?
The molecular formula of Benzylhexadecyldimethylammonium chloride is C25H46ClN.
What is the molecular weight of Benzylhexadecyldimethylammonium chloride?
The molecular weight of Benzylhexadecyldimethylammonium chloride is 395.33188 g/mol.
Where can I buy Benzylhexadecyldimethylammonium chloride?
You can request a quote for Benzylhexadecyldimethylammonium chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzylhexadecyldimethylammonium chloride?
Yes, CoreyChem provides custom synthesis services for Benzylhexadecyldimethylammonium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.