1-(4-Chlorobenzyl)-1-methylpiperidinium
TL;DR: 1-(4-Chlorobenzyl)-1-methylpiperidinium (CAS 754129-85-6) is a chemical compound with molecular formula C13H19ClN+ and molecular weight 224.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-chlorophenyl)methyl]-1-methylpiperidin-1-ium
Also Known As: 1-(4-chlorobenzyl)-1-methylpiperidinium, 1-[(4-chlorophenyl)methyl]-1-methylpiperidin-1-ium, 1-[(4-chlorophenyl)methyl]-1-methylpiperidine, AJ-087/25124006
| Molecular Formula | C13H19ClN+ |
|---|---|
| Molecular Weight | 224.12 g/mol |
| LogP | 3.4705 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.1206 |
| Heavy Atoms | 15 |
| Complexity | 311.81277 |
Chemical Identifiers
| CAS Number | 754129-85-6 |
|---|---|
| SMILES | C[N+]1(CCCCC1)CC2=CC=C(C=C2)Cl |
Product Overview
1-(4-Chlorobenzyl)-1-methylpiperidinium (CAS 754129-85-6), with molecular formula C13H19ClN+ and molecular weight 224.12 g/mol. IUPAC: 1-[(4-chlorophenyl)methyl]-1-methylpiperidin-1-ium.
Chemical Property Profile of 1-(4-Chlorobenzyl)-1-methylpiperidinium
Property Insights of 1-(4-Chlorobenzyl)-1-methylpiperidinium
The XLogP value of 3.4705 indicates that 1-(4-Chlorobenzyl)-1-methylpiperidinium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-(4-Chlorobenzyl)-1-methylpiperidinium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorobenzyl)-1-methylpiperidinium has 0 hydrogen bond donor(s) and 0 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 1-(4-Chlorobenzyl)-1-methylpiperidinium?
The CAS number of 1-(4-Chlorobenzyl)-1-methylpiperidinium is 754129-85-6.
What is the molecular formula of 1-(4-Chlorobenzyl)-1-methylpiperidinium?
The molecular formula of 1-(4-Chlorobenzyl)-1-methylpiperidinium is C13H19ClN+.
What is the molecular weight of 1-(4-Chlorobenzyl)-1-methylpiperidinium?
The molecular weight of 1-(4-Chlorobenzyl)-1-methylpiperidinium is 224.12 g/mol.
Where can I buy 1-(4-Chlorobenzyl)-1-methylpiperidinium?
You can request a quote for 1-(4-Chlorobenzyl)-1-methylpiperidinium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorobenzyl)-1-methylpiperidinium?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorobenzyl)-1-methylpiperidinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.