Behenalkonium chloride
TL;DR: Behenalkonium chloride (CAS 16841-14-8) is a chemical compound with molecular formula C31H58ClN and molecular weight 479.43 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl-docosyl-dimethylazanium chloride
Also Known As: Behenalkonium chloride, GENAMIN KDB, INCROQUAT B 65C, Benzyldocosyldimethylammonium chloride, Ammonium, benzyldocosyldimethyl-, chloride
| Molecular Formula | C31H58ClN |
|---|---|
| Molecular Weight | 479.43 g/mol |
| LogP | 7.0889 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 23 |
| Exact Mass | 479.42578 |
| Heavy Atoms | 33 |
| Complexity | 498.9045 |
Chemical Identifiers
| CAS Number | 16841-14-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-] |
Product Overview
Behenalkonium chloride (CAS 16841-14-8), with molecular formula C31H58ClN and molecular weight 479.43 g/mol. IUPAC: benzyl-docosyl-dimethylazanium chloride.
Chemical Property Profile of Behenalkonium chloride
Property Insights of Behenalkonium chloride
The XLogP value of 7.0889 indicates that Behenalkonium 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, Behenalkonium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Behenalkonium chloride has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Behenalkonium chloride?
The CAS number of Behenalkonium chloride is 16841-14-8.
What is the molecular formula of Behenalkonium chloride?
The molecular formula of Behenalkonium chloride is C31H58ClN.
What is the molecular weight of Behenalkonium chloride?
The molecular weight of Behenalkonium chloride is 479.43 g/mol.
Where can I buy Behenalkonium chloride?
You can request a quote for Behenalkonium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Behenalkonium chloride?
Yes, KEHONG BIO provides custom synthesis services for Behenalkonium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.