3-(2-Chlorobenzyl)pyrrolidine
TL;DR: 3-(2-Chlorobenzyl)pyrrolidine (CAS 1003561-98-5) is a chemical compound with molecular formula C11H14ClN and molecular weight 195.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-chlorophenyl)methyl]pyrrolidine
Also Known As: 3-(2-CHLOROBENZYL)PYRROLIDINE, 3-[(2-chlorophenyl)methyl]pyrrolidine, 3-[(2-Chlorophenyl)methyl]pyrrolidine HCl, 3ABX-Q06-1
| Molecular Formula | C11H14ClN |
|---|---|
| Molecular Weight | 195.08 g/mol |
| LogP | 2.492 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 195.08148 |
| Heavy Atoms | 13 |
| Complexity | 279.1737 |
Chemical Identifiers
| CAS Number | 1003561-98-5 |
|---|---|
| SMILES | C1CNCC1CC2=CC=CC=C2Cl |
Product Overview
3-(2-Chlorobenzyl)pyrrolidine (CAS 1003561-98-5), with molecular formula C11H14ClN and molecular weight 195.08 g/mol. IUPAC: 3-[(2-chlorophenyl)methyl]pyrrolidine.
Chemical Property Profile of 3-(2-Chlorobenzyl)pyrrolidine
Property Insights of 3-(2-Chlorobenzyl)pyrrolidine
The XLogP value of 2.492 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Chlorobenzyl)pyrrolidine. With a topological polar surface area (TPSA) of 12.03 Ų, 3-(2-Chlorobenzyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Chlorobenzyl)pyrrolidine 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 3-(2-Chlorobenzyl)pyrrolidine?
The CAS number of 3-(2-Chlorobenzyl)pyrrolidine is 1003561-98-5.
What is the molecular formula of 3-(2-Chlorobenzyl)pyrrolidine?
The molecular formula of 3-(2-Chlorobenzyl)pyrrolidine is C11H14ClN.
What is the molecular weight of 3-(2-Chlorobenzyl)pyrrolidine?
The molecular weight of 3-(2-Chlorobenzyl)pyrrolidine is 195.08 g/mol.
Where can I buy 3-(2-Chlorobenzyl)pyrrolidine?
You can request a quote for 3-(2-Chlorobenzyl)pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Chlorobenzyl)pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Chlorobenzyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.