2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid
TL;DR: 2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid (CAS 749269-75-8) is a chemical compound with molecular formula C16H12F4O2 and molecular weight 312.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-fluoro-4-[4-(trifluoromethyl)phenyl]phenyl]propanoic acid
Also Known As: 2-(2-fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid, 2-(2-Fluoro-4''-trifluoromethyl-biphenyl-4-yl)-propionic acid, 2-[3-fluoro-4-[4-(trifluoromethyl)phenyl]phenyl]propanoic Acid, 2-[2-Fluoro-4'-(trifluoromethyl)[1,1'-biphenyl]-4-yl]propanoic acid, 2-Fluoro-I+/--methyl-4a(2)-(trifluoromethyl)[1,1a(2)-biphenyl]-4-acetic acid
| Molecular Formula | C16H12F4O2 |
|---|---|
| Molecular Weight | 312.08 g/mol |
| LogP | 4.6996 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.07733 |
| Heavy Atoms | 22 |
| Complexity | 690.2823 |
Chemical Identifiers
| CAS Number | 749269-75-8 |
|---|---|
| SMILES | CC(C1=CC(=C(C=C1)C2=CC=C(C=C2)C(F)(F)F)F)C(=O)O |
Product Overview
2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid (CAS 749269-75-8), with molecular formula C16H12F4O2 and molecular weight 312.08 g/mol. IUPAC: 2-[3-fluoro-4-[4-(trifluoromethyl)phenyl]phenyl]propanoic acid.
Chemical Property Profile of 2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid
Property Insights of 2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid
The XLogP value of 4.6996 indicates that 2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid has 1 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 2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid?
The CAS number of 2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid is 749269-75-8.
What is the molecular formula of 2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid?
The molecular formula of 2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid is C16H12F4O2.
What is the molecular weight of 2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid?
The molecular weight of 2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid is 312.08 g/mol.
Where can I buy 2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid?
You can request a quote for 2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Fluoro-4'-trifluoromethylbiphenyl-4-yl)propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.