1-(2-Chloroethoxy)butane
TL;DR: 1-(2-Chloroethoxy)butane (CAS 10503-96-5) is a chemical compound with molecular formula C6H13ClO and molecular weight 136.06549 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-chloroethoxy)butane
Also Known As: 1-(2-Chloroethoxy)butane, Butyl 2-Chloroethyl Ether, 2-Chloroethyl n-Butyl Ether, 4-chloroethoxybutane, Butane, 1-(2-chloroethoxy)-
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H13ClO |
| Molecular Weight | 136.06549 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 136.06549 Da |
| Heavy Atoms | 8 |
| Complexity | 39.0 |
| SMILES | CCCCOCCCl |
| InChIKey | OJMVRGXLTANFRG-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2-Chloroethoxy)butane
Property Insights of 1-(2-Chloroethoxy)butane
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chloroethoxy)butane. With a topological polar surface area (TPSA) of 9.2 Ų, 1-(2-Chloroethoxy)butane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Chloroethoxy)butane 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
What is the CAS number of 1-(2-Chloroethoxy)butane?
The CAS number of 1-(2-Chloroethoxy)butane is 10503-96-5.
What is the molecular formula of 1-(2-Chloroethoxy)butane?
The molecular formula of 1-(2-Chloroethoxy)butane is C6H13ClO.
What is the molecular weight of 1-(2-Chloroethoxy)butane?
The molecular weight of 1-(2-Chloroethoxy)butane is 136.06549 g/mol.
Where can I buy 1-(2-Chloroethoxy)butane?
You can request a quote for 1-(2-Chloroethoxy)butane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2-Chloroethoxy)butane?
Yes, CoreyChem provides custom synthesis services for 1-(2-Chloroethoxy)butane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.