Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride
TL;DR: Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride (CAS 13409-72-8) 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-(2-chloroethyl)pyrrolidine;hydrochloride
Also Known As: 2-Chloroethylpyrrolidine hydrochloride, 2-(2-chloroethyl)pyrrolidine hydrochloride, Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride, 2-(2-chloroethyl)pyrrolidine,hydrochloride, 2-(2-Chloroethyl)pyrrolidine--hydrogen chloride (1/1)
| Molecular Formula | C6H13Cl2N |
|---|---|
| Molecular Weight | 169.04 g/mol |
| LogP | 1.7891 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 169.04251 |
| Heavy Atoms | 9 |
| Complexity | 65.0 |
Chemical Identifiers
| CAS Number | 13409-72-8 |
|---|---|
| SMILES | C1CC(NC1)CCCl.Cl |
| InChIKey | RGUJKYQDJZCYJB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride (CAS 13409-72-8), with molecular formula C6H13Cl2N and molecular weight 169.04 g/mol. IUPAC: 2-(2-chloroethyl)pyrrolidine;hydrochloride.
Chemical Property Profile of Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride
Property Insights of Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride
The XLogP value of 1.7891 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride. With a topological polar surface area (TPSA) of 12.0 Ų, Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride has 2 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 Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride?
The CAS number of Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride is 13409-72-8.
What is the molecular formula of Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride?
The molecular formula of Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride is C6H13Cl2N.
What is the molecular weight of Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride?
The molecular weight of Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride is 169.04 g/mol.
Where can I buy Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride?
You can request a quote for Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidine, 2-(2-chloroethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.