3-(Chloromethyl)-1-methylpiperidine
TL;DR: 3-(Chloromethyl)-1-methylpiperidine (CAS 52694-50-5) is a chemical compound with molecular formula C7H14ClN and molecular weight 147.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(chloromethyl)-1-methylpiperidine
Also Known As: 3-(Chloromethyl)-1-methylpiperidine, 3-Chloromethyl-1-methyl-piperidine, 3-Chloro-1,2-propanediol, 3-Chloromethyl-1-methylpiperidine, 3-chloromethyl-N-methylpiperidine
| Molecular Formula | C7H14ClN |
|---|---|
| Molecular Weight | 147.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 147.08148 |
| Heavy Atoms | 9 |
| Complexity | 85.0 |
Chemical Identifiers
| CAS Number | 52694-50-5 |
|---|---|
| SMILES | CN1CCCC(C1)CCl |
| InChIKey | FFOIFAAVWJZLFE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Chloromethyl)-1-methylpiperidine (CAS 52694-50-5), with molecular formula C7H14ClN and molecular weight 147.08 g/mol. IUPAC: 3-(chloromethyl)-1-methylpiperidine.
Chemical Property Profile of 3-(Chloromethyl)-1-methylpiperidine
Property Insights of 3-(Chloromethyl)-1-methylpiperidine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Chloromethyl)-1-methylpiperidine. With a topological polar surface area (TPSA) of 3.2 Ų, 3-(Chloromethyl)-1-methylpiperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Chloromethyl)-1-methylpiperidine 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 3-(Chloromethyl)-1-methylpiperidine?
The CAS number of 3-(Chloromethyl)-1-methylpiperidine is 52694-50-5.
What is the molecular formula of 3-(Chloromethyl)-1-methylpiperidine?
The molecular formula of 3-(Chloromethyl)-1-methylpiperidine is C7H14ClN.
What is the molecular weight of 3-(Chloromethyl)-1-methylpiperidine?
The molecular weight of 3-(Chloromethyl)-1-methylpiperidine is 147.08 g/mol.
Where can I buy 3-(Chloromethyl)-1-methylpiperidine?
You can request a quote for 3-(Chloromethyl)-1-methylpiperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Chloromethyl)-1-methylpiperidine?
Yes, KEHONG BIO provides custom synthesis services for 3-(Chloromethyl)-1-methylpiperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.