4-Fluorosalicylic acid
TL;DR: 4-Fluorosalicylic acid (CAS 345-29-9) is a chemical compound with molecular formula C7H5FO3 and molecular weight 156.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-fluoro-2-hydroxybenzoic acid
Also Known As: 4-Fluoro-2-hydroxybenzoic Acid, 4-Fluorosalicylic acid, 4-fluorosalicyclic acid, 2-hydroxy-4-fluorobenzoic acid, zlchem 109
| Molecular Formula | C7H5FO3 |
|---|---|
| Molecular Weight | 156.02 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.02228 |
| Heavy Atoms | 11 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 345-29-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1F)O)C(=O)O |
| InChIKey | TTZOLDXHOCCNMF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Fluorosalicylic acid (CAS 345-29-9), with molecular formula C7H5FO3 and molecular weight 156.02 g/mol. IUPAC: 4-fluoro-2-hydroxybenzoic acid.
Chemical Property Profile of 4-Fluorosalicylic acid
Property Insights of 4-Fluorosalicylic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Fluorosalicylic acid. With a topological polar surface area (TPSA) of 57.5 Ų, 4-Fluorosalicylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Fluorosalicylic acid has 2 hydrogen bond donor(s) and 4 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 4-Fluorosalicylic acid?
The CAS number of 4-Fluorosalicylic acid is 345-29-9.
What is the molecular formula of 4-Fluorosalicylic acid?
The molecular formula of 4-Fluorosalicylic acid is C7H5FO3.
What is the molecular weight of 4-Fluorosalicylic acid?
The molecular weight of 4-Fluorosalicylic acid is 156.02 g/mol.
Where can I buy 4-Fluorosalicylic acid?
You can request a quote for 4-Fluorosalicylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Fluorosalicylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Fluorosalicylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.