1-(2-Chloroethoxy)propane
TL;DR: 1-(2-Chloroethoxy)propane (CAS 4545-21-5) is a chemical compound with molecular formula CCCOCCCl and molecular weight 122.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethoxy)propane
Also Known As: 1-(2-Chloroethoxy)propane, 2-Propoxyethyl chloride, 2-Chloroethyl Propyl Ether, 2-Chloroethyl-n-propylether, chloroethoxypropane
| Molecular Formula | CCCOCCCl |
|---|---|
| Molecular Weight | 122.05 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 122.04984 |
| Heavy Atoms | 7 |
| Complexity | 31.0 |
Chemical Identifiers
| CAS Number | 4545-21-5 |
|---|---|
| SMILES | CCCOCCCl |
| InChIKey | BHDSGQOSIWVMJW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2-Chloroethoxy)propane (CAS 4545-21-5), with molecular formula CCCOCCCl and molecular weight 122.05 g/mol. IUPAC: 1-(2-chloroethoxy)propane.
Chemical Property Profile of 1-(2-Chloroethoxy)propane
Property Insights of 1-(2-Chloroethoxy)propane
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chloroethoxy)propane. With a topological polar surface area (TPSA) of 9.2 Ų, 1-(2-Chloroethoxy)propane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Chloroethoxy)propane 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 1-(2-Chloroethoxy)propane?
The CAS number of 1-(2-Chloroethoxy)propane is 4545-21-5.
What is the molecular formula of 1-(2-Chloroethoxy)propane?
The molecular formula of 1-(2-Chloroethoxy)propane is CCCOCCCl.
What is the molecular weight of 1-(2-Chloroethoxy)propane?
The molecular weight of 1-(2-Chloroethoxy)propane is 122.05 g/mol.
Where can I buy 1-(2-Chloroethoxy)propane?
You can request a quote for 1-(2-Chloroethoxy)propane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Chloroethoxy)propane?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Chloroethoxy)propane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.