Ether, 4-chlorobutyl 4-fluorobutyl
TL;DR: Ether, 4-chlorobutyl 4-fluorobutyl (CAS 593-22-6) is a chemical compound with molecular formula C8H16ClFO and molecular weight 182.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorobutoxy)-4-fluorobutane
Also Known As: 4-Fluoro-4'-chlorodibutyl ether, 4-Chloro-4'-fluorodibutyl ether, 1-(4-chlorobutoxy)-4-fluorobutane, ETHER, 4-CHLOROBUTYL 4-FLUOROBUTYL, 4-Chloro-4'-fluoro-1,1'-oxybisbutane
| Molecular Formula | C8H16ClFO |
|---|---|
| Molecular Weight | 182.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 182.08737 |
| Heavy Atoms | 11 |
| Complexity | 71.0 |
Chemical Identifiers
| CAS Number | 593-22-6 |
|---|---|
| SMILES | C(CCF)COCCCCCl |
| InChIKey | NPERCMMNVGTKTP-UHFFFAOYSA-N |
Product Overview
Ether, 4-chlorobutyl 4-fluorobutyl (CAS 593-22-6), with molecular formula C8H16ClFO and molecular weight 182.09 g/mol. IUPAC: 1-(4-chlorobutoxy)-4-fluorobutane.
Chemical Property Profile of Ether, 4-chlorobutyl 4-fluorobutyl
Property Insights of Ether, 4-chlorobutyl 4-fluorobutyl
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ether, 4-chlorobutyl 4-fluorobutyl. With a topological polar surface area (TPSA) of 9.2 Ų, Ether, 4-chlorobutyl 4-fluorobutyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ether, 4-chlorobutyl 4-fluorobutyl has 0 hydrogen bond donor(s) and 2 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 Ether, 4-chlorobutyl 4-fluorobutyl?
The CAS number of Ether, 4-chlorobutyl 4-fluorobutyl is 593-22-6.
What is the molecular formula of Ether, 4-chlorobutyl 4-fluorobutyl?
The molecular formula of Ether, 4-chlorobutyl 4-fluorobutyl is C8H16ClFO.
What is the molecular weight of Ether, 4-chlorobutyl 4-fluorobutyl?
The molecular weight of Ether, 4-chlorobutyl 4-fluorobutyl is 182.09 g/mol.
Where can I buy Ether, 4-chlorobutyl 4-fluorobutyl?
You can request a quote for Ether, 4-chlorobutyl 4-fluorobutyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ether, 4-chlorobutyl 4-fluorobutyl?
Yes, KEHONG BIO provides custom synthesis services for Ether, 4-chlorobutyl 4-fluorobutyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.