TL;DR: 2-(3'-(Trifluoromethyl)-[1,1'-biphenyl]-3-yl)acetic acid (CAS 1224742-15-7) is a chemical compound with molecular formula C15H11F3O2 and molecular weight 280.0711 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[3-[3-(trifluoromethyl)phenyl]phenyl]acetic acid
Also Known As: 2-(3'-(Trifluoromethyl)-[1,1'-biphenyl]-3-yl)acetic acid, {3-[3-(trifluoromethyl)phenyl]phenyl}acetic acid, 4266AA, {3-[3-(Trifluoromethyl)phenyl]phenyl}, 2-[3-[3-(trifluoromethyl)phenyl]phenyl]acetic acid
| Molecular Formula | C15H11F3O2 |
| Molecular Weight | 280.0711 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.0711 Da |
| Heavy Atoms | 20 |
| Complexity | 341.0 |
| SMILES | C1=CC(=CC(=C1)C2=CC(=CC=C2)C(F)(F)F)CC(=O)O |
| InChIKey | VQRUXJYTJUYMPY-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that 2-(3'-(Trifluoromethyl)-[1,1'-biphenyl]-3-yl)acetic 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-(3'-(Trifluoromethyl)-[1,1'-biphenyl]-3-yl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3'-(Trifluoromethyl)-[1,1'-biphenyl]-3-yl)acetic acid has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(3'-(Trifluoromethyl)-[1,1'-biphenyl]-3-yl)acetic acid is 1224742-15-7.
The molecular formula of 2-(3'-(Trifluoromethyl)-[1,1'-biphenyl]-3-yl)acetic acid is C15H11F3O2.
The molecular weight of 2-(3'-(Trifluoromethyl)-[1,1'-biphenyl]-3-yl)acetic acid is 280.0711 g/mol.
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