4-Cyano-4'-(Trifluoromethyl)biphenyl
TL;DR: 4-Cyano-4'-(Trifluoromethyl)biphenyl (CAS 140483-60-9) is a chemical compound with molecular formula C14H8F3N and molecular weight 247.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(trifluoromethyl)phenyl]benzonitrile
Also Known As: 4-Cyano-4'-(Trifluoromethyl)biphenyl, 4-[4-(trifluoromethyl)phenyl]benzonitrile, 4'-(Trifluoromethyl)[1,1'-biphenyl]-4-carbonitrile, 4-(4-trifluoromethylphenyl)benzonitrile, 4-Cyano-4''-(Trifluoromethyl)biphenyl
| Molecular Formula | C14H8F3N |
|---|---|
| Molecular Weight | 247.06 g/mol |
| LogP | 4.24408 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 247.06088 |
| Heavy Atoms | 18 |
| Complexity | 574.4216 |
Chemical Identifiers
| CAS Number | 140483-60-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C#N)C2=CC=C(C=C2)C(F)(F)F |
Product Overview
4-Cyano-4'-(Trifluoromethyl)biphenyl (CAS 140483-60-9), with molecular formula C14H8F3N and molecular weight 247.06 g/mol. IUPAC: 4-[4-(trifluoromethyl)phenyl]benzonitrile.
Chemical Property Profile of 4-Cyano-4'-(Trifluoromethyl)biphenyl
Property Insights of 4-Cyano-4'-(Trifluoromethyl)biphenyl
The XLogP value of 4.24408 indicates that 4-Cyano-4'-(Trifluoromethyl)biphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.79 Ų, 4-Cyano-4'-(Trifluoromethyl)biphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Cyano-4'-(Trifluoromethyl)biphenyl 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 4-Cyano-4'-(Trifluoromethyl)biphenyl?
The CAS number of 4-Cyano-4'-(Trifluoromethyl)biphenyl is 140483-60-9.
What is the molecular formula of 4-Cyano-4'-(Trifluoromethyl)biphenyl?
The molecular formula of 4-Cyano-4'-(Trifluoromethyl)biphenyl is C14H8F3N.
What is the molecular weight of 4-Cyano-4'-(Trifluoromethyl)biphenyl?
The molecular weight of 4-Cyano-4'-(Trifluoromethyl)biphenyl is 247.06 g/mol.
Where can I buy 4-Cyano-4'-(Trifluoromethyl)biphenyl?
You can request a quote for 4-Cyano-4'-(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-Cyano-4'-(Trifluoromethyl)biphenyl?
Yes, KEHONG BIO provides custom synthesis services for 4-Cyano-4'-(Trifluoromethyl)biphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.