苄基十六烷基二甲基氯化铵
TL;DR: 苄基十六烷基二甲基氯化铵 (CAS 122-18-9) is a chemical compound with molecular formula C25H46ClN and molecular weight 395.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苄基十六烷基二甲基氯化铵
benzyl-hexadecyl-dimethylazanium chloride
Also Known As: Cetalkonium chloride, Cetyl zephiran, Benzyldimethylhexadecylammonium chloride, Banicol, Acinol
| Molecular Formula | C25H46ClN |
|---|---|
| Molecular Weight | 395.33 g/mol |
| LogP | 4.75 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 17 |
| Exact Mass | 395.33188 |
| Heavy Atoms | 27 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 122-18-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-] |
| InChIKey | SXPWTBGAZSPLHA-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
苄基十六烷基二甲基氯化铵 (CAS 122-18-9), with molecular formula C25H46ClN and molecular weight 395.33 g/mol. IUPAC: benzyl-hexadecyl-dimethylazanium chloride.
Chemical Property Profile of 苄基十六烷基二甲基氯化铵
Property Insights of 苄基十六烷基二甲基氯化铵
The XLogP value of 4.75 indicates that 苄基十六烷基二甲基氯化铵 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 苄基十六烷基二甲基氯化铵 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 苄基十六烷基二甲基氯化铵 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
Frequently Asked Questions
What is the CAS number of 苄基十六烷基二甲基氯化铵?
The CAS number of 苄基十六烷基二甲基氯化铵 is 122-18-9.
What is the molecular formula of 苄基十六烷基二甲基氯化铵?
The molecular formula of 苄基十六烷基二甲基氯化铵 is C25H46ClN.
What is the molecular weight of 苄基十六烷基二甲基氯化铵?
The molecular weight of 苄基十六烷基二甲基氯化铵 is 395.33 g/mol.
Where can I buy 苄基十六烷基二甲基氯化铵?
You can request a quote for 苄基十六烷基二甲基氯化铵 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苄基十六烷基二甲基氯化铵?
Yes, KEHONG BIO provides custom synthesis services for 苄基十六烷基二甲基氯化铵 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.