3-(Chloromethyl)-1-methylpyrrolidine
TL;DR: 3-(Chloromethyl)-1-methylpyrrolidine (CAS 58689-43-3) is a chemical compound with molecular formula C6H12ClN and molecular weight 133.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(chloromethyl)-1-methylpyrrolidine
Also Known As: 3-(chloromethyl)-1-methylpyrrolidine, 3-Chloromethyl-1-methyl-pyrrolidine, CBI-BB ZERO/004820, ZERO/004820, 1-Methyl-3-chlormethyl-pyrrolidin
| Molecular Formula | C6H12ClN |
|---|---|
| Molecular Weight | 133.07 g/mol |
| LogP | 1.1769 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 133.06583 |
| Heavy Atoms | 8 |
| Complexity | 74.92879 |
Chemical Identifiers
| CAS Number | 58689-43-3 |
|---|---|
| SMILES | CN1CCC(C1)CCl |
Product Overview
3-(Chloromethyl)-1-methylpyrrolidine (CAS 58689-43-3), with molecular formula C6H12ClN and molecular weight 133.07 g/mol. IUPAC: 3-(chloromethyl)-1-methylpyrrolidine.
Chemical Property Profile of 3-(Chloromethyl)-1-methylpyrrolidine
Property Insights of 3-(Chloromethyl)-1-methylpyrrolidine
The XLogP value of 1.1769 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Chloromethyl)-1-methylpyrrolidine. With a topological polar surface area (TPSA) of 3.24 Ų, 3-(Chloromethyl)-1-methylpyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Chloromethyl)-1-methylpyrrolidine 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-methylpyrrolidine?
The CAS number of 3-(Chloromethyl)-1-methylpyrrolidine is 58689-43-3.
What is the molecular formula of 3-(Chloromethyl)-1-methylpyrrolidine?
The molecular formula of 3-(Chloromethyl)-1-methylpyrrolidine is C6H12ClN.
What is the molecular weight of 3-(Chloromethyl)-1-methylpyrrolidine?
The molecular weight of 3-(Chloromethyl)-1-methylpyrrolidine is 133.07 g/mol.
Where can I buy 3-(Chloromethyl)-1-methylpyrrolidine?
You can request a quote for 3-(Chloromethyl)-1-methylpyrrolidine 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-methylpyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 3-(Chloromethyl)-1-methylpyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.