2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl
TL;DR: 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl (CAS 4841-74-1) is a chemical compound with molecular formula C16H14F4O2 and molecular weight 314.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethoxy-3-(2-ethoxy-3,6-difluorophenyl)-1,4-difluorobenzene
Also Known As: 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl, 2-ethoxy-3-(2-ethoxy-3,6-difluorophenyl)-1,4-difluorobenzene, RefChem:242253
| Molecular Formula | C16H14F4O2 |
|---|---|
| Molecular Weight | 314.09 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 314.093 |
| Heavy Atoms | 22 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 4841-74-1 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1C2=C(C=CC(=C2OCC)F)F)F)F |
| InChIKey | GXQXJCSAZSYSQD-UHFFFAOYSA-N |
Product Overview
2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl (CAS 4841-74-1), with molecular formula C16H14F4O2 and molecular weight 314.09 g/mol. IUPAC: 2-ethoxy-3-(2-ethoxy-3,6-difluorophenyl)-1,4-difluorobenzene.
Chemical Property Profile of 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl
Property Insights of 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl
The XLogP value of 4.6 indicates that 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl has 0 hydrogen bond donor(s) and 6 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 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl?
The CAS number of 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl is 4841-74-1.
What is the molecular formula of 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl?
The molecular formula of 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl is C16H14F4O2.
What is the molecular weight of 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl?
The molecular weight of 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl is 314.09 g/mol.
Where can I buy 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl?
You can request a quote for 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-Diethoxy-3,3',6,6'-tetrafluoro-1,1'-biphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.