1-Chloro-4-ethoxybutane
TL;DR: 1-Chloro-4-ethoxybutane (CAS 36865-43-7) is a chemical compound with molecular formula C6H13ClO and molecular weight 136.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-ethoxybutane
Also Known As: 1-Chloro-4-ethoxybutane, 1-chloro-4-ethoxybtuane, 4-ethoxybutylchloride, ethyl 4-chlorobutyl ether, Butane, 1-chloro-4-ethoxy-
| Molecular Formula | C6H13ClO |
|---|---|
| Molecular Weight | 136.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 136.06549 |
| Heavy Atoms | 8 |
| Complexity | 39.0 |
Chemical Identifiers
| CAS Number | 36865-43-7 |
|---|---|
| SMILES | CCOCCCCCl |
| InChIKey | IXRDURXALZYREB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Chloro-4-ethoxybutane (CAS 36865-43-7), with molecular formula C6H13ClO and molecular weight 136.07 g/mol. IUPAC: 1-chloro-4-ethoxybutane.
Chemical Property Profile of 1-Chloro-4-ethoxybutane
Property Insights of 1-Chloro-4-ethoxybutane
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Chloro-4-ethoxybutane. With a topological polar surface area (TPSA) of 9.2 Ų, 1-Chloro-4-ethoxybutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-4-ethoxybutane 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-Chloro-4-ethoxybutane?
The CAS number of 1-Chloro-4-ethoxybutane is 36865-43-7.
What is the molecular formula of 1-Chloro-4-ethoxybutane?
The molecular formula of 1-Chloro-4-ethoxybutane is C6H13ClO.
What is the molecular weight of 1-Chloro-4-ethoxybutane?
The molecular weight of 1-Chloro-4-ethoxybutane is 136.07 g/mol.
Where can I buy 1-Chloro-4-ethoxybutane?
You can request a quote for 1-Chloro-4-ethoxybutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-4-ethoxybutane?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-4-ethoxybutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.