4-Benzyloxy-3-fluorophenylacetic acid
TL;DR: 4-Benzyloxy-3-fluorophenylacetic acid (CAS 127414-05-5) is a chemical compound with molecular formula C15H13FO3 and molecular weight 260.08487 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-fluoro-4-phenylmethoxyphenyl)acetic acid
Also Known As: 4-benzyloxy-3-fluorophenylacetic acid, 2-(3-fluoro-4-phenylmethoxyphenyl)acetic acid, 2-(3-fluoro-4-phenylmethoxy-phenyl)acetic Acid, 2-(4-(BENZYLOXY)-3-FLUOROPHENYL)ACETIC ACID
Technical Specifications
| Molecular Formula | C15H13FO3 |
| Molecular Weight | 260.08487 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 260.08487 Da |
| Heavy Atoms | 19 |
| Complexity | 289.0 |
| SMILES | C1=CC=C(C=C1)COC2=C(C=C(C=C2)CC(=O)O)F |
| InChIKey | WQYBIHZSMNVHNP-UHFFFAOYSA-N |
Chemical Property Profile of 4-Benzyloxy-3-fluorophenylacetic acid
Property Insights of 4-Benzyloxy-3-fluorophenylacetic acid
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Benzyloxy-3-fluorophenylacetic acid. With a topological polar surface area (TPSA) of 46.5 Ų, 4-Benzyloxy-3-fluorophenylacetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Benzyloxy-3-fluorophenylacetic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Benzyloxy-3-fluorophenylacetic acid?
The CAS number of 4-Benzyloxy-3-fluorophenylacetic acid is 127414-05-5.
What is the molecular formula of 4-Benzyloxy-3-fluorophenylacetic acid?
The molecular formula of 4-Benzyloxy-3-fluorophenylacetic acid is C15H13FO3.
What is the molecular weight of 4-Benzyloxy-3-fluorophenylacetic acid?
The molecular weight of 4-Benzyloxy-3-fluorophenylacetic acid is 260.08487 g/mol.
Where can I buy 4-Benzyloxy-3-fluorophenylacetic acid?
You can request a quote for 4-Benzyloxy-3-fluorophenylacetic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Benzyloxy-3-fluorophenylacetic acid?
Yes, CoreyChem provides custom synthesis services for 4-Benzyloxy-3-fluorophenylacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.