![4,4'-Bis[trifluoromethyl]biphenyl structure](/static/products/5818/581-80-6.webp)
4,4'-Bis[trifluoromethyl]biphenyl
TL;DR: 4,4'-Bis[trifluoromethyl]biphenyl (CAS 581-80-6) is a chemical compound with molecular formula C14H8F6 and molecular weight 290.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(trifluoromethyl)-4-[4-(trifluoromethyl)phenyl]benzene
Also Known As: 4,4'-Bis(trifluoromethyl)biphenyl, 4,4'-Bis(trifluoromethyl)-1,1'-biphenyl, 4,4'-Bis[trifluoromethyl]biphenyl, bis(trifluoromethyl)biphenyl, 1,1'-Biphenyl, 4,4'-bis(trifluoromethyl)-
| Molecular Formula | C14H8F6 |
|---|---|
| Molecular Weight | 290.05 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.053 |
| Heavy Atoms | 20 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 581-80-6 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC=C(C=C2)C(F)(F)F)C(F)(F)F |
| InChIKey | ITBRQMPOQQZNFT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4'-Bis[trifluoromethyl]biphenyl (CAS 581-80-6), with molecular formula C14H8F6 and molecular weight 290.05 g/mol. IUPAC: 1-(trifluoromethyl)-4-[4-(trifluoromethyl)phenyl]benzene.
Chemical Property Profile of 4,4'-Bis[trifluoromethyl]biphenyl
Property Insights of 4,4'-Bis[trifluoromethyl]biphenyl
The XLogP value of 5.5 indicates that 4,4'-Bis[trifluoromethyl]biphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 4,4'-Bis[trifluoromethyl]biphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-Bis[trifluoromethyl]biphenyl has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4'-Bis[trifluoromethyl]biphenyl?
The CAS number of 4,4'-Bis[trifluoromethyl]biphenyl is 581-80-6.
What is the molecular formula of 4,4'-Bis[trifluoromethyl]biphenyl?
The molecular formula of 4,4'-Bis[trifluoromethyl]biphenyl is C14H8F6.
What is the molecular weight of 4,4'-Bis[trifluoromethyl]biphenyl?
The molecular weight of 4,4'-Bis[trifluoromethyl]biphenyl is 290.05 g/mol.
Where can I buy 4,4'-Bis[trifluoromethyl]biphenyl?
You can request a quote for 4,4'-Bis[trifluoromethyl]biphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-Bis[trifluoromethyl]biphenyl?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-Bis[trifluoromethyl]biphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.