5-Chloro-2-fluorophenylacetic acid
TL;DR: 5-Chloro-2-fluorophenylacetic acid (CAS 1268524-70-4) is a chemical compound with molecular formula C8H6ClFO2 and molecular weight 188.00403 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(5-chloro-2-fluorophenyl)acetic acid
Also Known As: 5-Chloro-2-fluorophenylacetic acid, 2-(5-chloro-2-fluorophenyl)acetic acid, (5-chloro-2-fluorophenyl)acetic acid, Benzeneacetic acid, 5-chloro-2-fluoro-, 5-chloro-2-fluoro-phenylacetic acid
Technical Specifications
| Molecular Formula | C8H6ClFO2 |
| Molecular Weight | 188.00403 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.00403 Da |
| Heavy Atoms | 12 |
| Complexity | 174.0 |
| SMILES | C1=CC(=C(C=C1Cl)CC(=O)O)F |
| InChIKey | NOKLOLLCDCEFAK-UHFFFAOYSA-N |
Chemical Property Profile of 5-Chloro-2-fluorophenylacetic acid
Property Insights of 5-Chloro-2-fluorophenylacetic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-2-fluorophenylacetic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 5-Chloro-2-fluorophenylacetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-2-fluorophenylacetic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Chloro-2-fluorophenylacetic acid?
The CAS number of 5-Chloro-2-fluorophenylacetic acid is 1268524-70-4.
What is the molecular formula of 5-Chloro-2-fluorophenylacetic acid?
The molecular formula of 5-Chloro-2-fluorophenylacetic acid is C8H6ClFO2.
What is the molecular weight of 5-Chloro-2-fluorophenylacetic acid?
The molecular weight of 5-Chloro-2-fluorophenylacetic acid is 188.00403 g/mol.
Where can I buy 5-Chloro-2-fluorophenylacetic acid?
You can request a quote for 5-Chloro-2-fluorophenylacetic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Chloro-2-fluorophenylacetic acid?
Yes, CoreyChem provides custom synthesis services for 5-Chloro-2-fluorophenylacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.