1-Ethoxy-2-chlorotetrafluorocyclobutene
TL;DR: 1-Ethoxy-2-chlorotetrafluorocyclobutene (CAS 360-13-4) is a chemical compound with molecular formula C6H5ClF4O and molecular weight 204.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-2-ethoxy-3,3,4,4-tetrafluorocyclobutene
Also Known As: 1-Ethoxy-2-chlorotetrafluorocyclobutene, 1-chloro-2-ethoxy-3,3,4,4-tetrafluorocyclobutene, 1-chloro-2-ethoxy-3,3,4,4-tetrafluorocyclobut-1-ene, 2-Chloro-3,3,4,4-tetrafluoro-1-cyclobuten-1-yl ether, 1-Chloro-2-ethoxy-3,3,4,4-tetrafluoro-1-cyclobutene #
| Molecular Formula | C6H5ClF4O |
|---|---|
| Molecular Weight | 204.00 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.9965 |
| Heavy Atoms | 12 |
| Complexity | 236.0 |
Chemical Identifiers
| CAS Number | 360-13-4 |
|---|---|
| SMILES | CCOC1=C(C(C1(F)F)(F)F)Cl |
| InChIKey | LRYDSFWJULJZLM-UHFFFAOYSA-N |
Product Overview
1-Ethoxy-2-chlorotetrafluorocyclobutene (CAS 360-13-4), with molecular formula C6H5ClF4O and molecular weight 204.00 g/mol. IUPAC: 1-chloro-2-ethoxy-3,3,4,4-tetrafluorocyclobutene.
Chemical Property Profile of 1-Ethoxy-2-chlorotetrafluorocyclobutene
Property Insights of 1-Ethoxy-2-chlorotetrafluorocyclobutene
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethoxy-2-chlorotetrafluorocyclobutene. With a topological polar surface area (TPSA) of 9.2 Ų, 1-Ethoxy-2-chlorotetrafluorocyclobutene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethoxy-2-chlorotetrafluorocyclobutene has 0 hydrogen bond donor(s) and 5 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-Ethoxy-2-chlorotetrafluorocyclobutene?
The CAS number of 1-Ethoxy-2-chlorotetrafluorocyclobutene is 360-13-4.
What is the molecular formula of 1-Ethoxy-2-chlorotetrafluorocyclobutene?
The molecular formula of 1-Ethoxy-2-chlorotetrafluorocyclobutene is C6H5ClF4O.
What is the molecular weight of 1-Ethoxy-2-chlorotetrafluorocyclobutene?
The molecular weight of 1-Ethoxy-2-chlorotetrafluorocyclobutene is 204.00 g/mol.
Where can I buy 1-Ethoxy-2-chlorotetrafluorocyclobutene?
You can request a quote for 1-Ethoxy-2-chlorotetrafluorocyclobutene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethoxy-2-chlorotetrafluorocyclobutene?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethoxy-2-chlorotetrafluorocyclobutene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.