TL;DR: 3-(4-Fluorophenoxy)propionic acid (CAS 1579-78-8) is a chemical compound with molecular formula C9H9FO3 and molecular weight 184.05357 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-fluorophenoxy)propanoic acid
Also Known As: 3-(4-Fluorophenoxy)propionic acid, 3-(4-fluorophenoxy)propanoic acid, Di-p-tolyl ether, Maybridge1_007558, rarechem al bo 1453
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H9FO3 |
| Molecular Weight | 184.05357 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 184.05357 Da |
| Heavy Atoms | 13 |
| Complexity | 164.0 |
| SMILES | C1=CC(=CC=C1OCCC(=O)O)F |
| InChIKey | QCEDXODAYRWQRH-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Fluorophenoxy)propionic acid. With a topological polar surface area (TPSA) of 46.5 Ų, 3-(4-Fluorophenoxy)propionic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Fluorophenoxy)propionic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(4-Fluorophenoxy)propionic acid is 1579-78-8.
The molecular formula of 3-(4-Fluorophenoxy)propionic acid is C9H9FO3.
The molecular weight of 3-(4-Fluorophenoxy)propionic acid is 184.05357 g/mol.
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