2-(Chloromethyl)-1-methylpyrrolidinium chloride
TL;DR: 2-(Chloromethyl)-1-methylpyrrolidinium chloride (CAS 67824-41-3) is a chemical compound with molecular formula C6H13Cl2N and molecular weight 169.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(chloromethyl)-1-methylpyrrolidine;hydrochloride
Also Known As: 2-(chloromethyl)-1-methylpyrrolidine hydrochloride, hydrochloride, 2-(Chloromethyl)-1-methylpyrrolidinium chloride, 2-CHLOROMETHYL-1-METHYL-PYRROLIDINE HYDROCHLORIDE, 2-Chloromethyl-1-methyl-pyrrolidine
| Molecular Formula | C6H13Cl2N |
|---|---|
| Molecular Weight | 169.04 g/mol |
| LogP | 1.7412 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 169.04251 |
| Heavy Atoms | 9 |
| Complexity | 74.0 |
Chemical Identifiers
| CAS Number | 67824-41-3 |
|---|---|
| SMILES | CN1CCCC1CCl.Cl |
| InChIKey | JMYYNTRVGBDWDB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Chloromethyl)-1-methylpyrrolidinium chloride (CAS 67824-41-3), with molecular formula C6H13Cl2N and molecular weight 169.04 g/mol. IUPAC: 2-(chloromethyl)-1-methylpyrrolidine;hydrochloride.
Chemical Property Profile of 2-(Chloromethyl)-1-methylpyrrolidinium chloride
Property Insights of 2-(Chloromethyl)-1-methylpyrrolidinium chloride
The XLogP value of 1.7412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Chloromethyl)-1-methylpyrrolidinium chloride. With a topological polar surface area (TPSA) of 3.2 Ų, 2-(Chloromethyl)-1-methylpyrrolidinium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Chloromethyl)-1-methylpyrrolidinium chloride has 1 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 2-(Chloromethyl)-1-methylpyrrolidinium chloride?
The CAS number of 2-(Chloromethyl)-1-methylpyrrolidinium chloride is 67824-41-3.
What is the molecular formula of 2-(Chloromethyl)-1-methylpyrrolidinium chloride?
The molecular formula of 2-(Chloromethyl)-1-methylpyrrolidinium chloride is C6H13Cl2N.
What is the molecular weight of 2-(Chloromethyl)-1-methylpyrrolidinium chloride?
The molecular weight of 2-(Chloromethyl)-1-methylpyrrolidinium chloride is 169.04 g/mol.
Where can I buy 2-(Chloromethyl)-1-methylpyrrolidinium chloride?
You can request a quote for 2-(Chloromethyl)-1-methylpyrrolidinium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Chloromethyl)-1-methylpyrrolidinium chloride?
Yes, KEHONG BIO provides custom synthesis services for 2-(Chloromethyl)-1-methylpyrrolidinium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.