3-Carboxy-4-fluorophenylboronic Acid
TL;DR: 3-Carboxy-4-fluorophenylboronic Acid (CAS 5211-06-3) is a chemical compound with molecular formula C7H6BFO4 and molecular weight 184.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-borono-2-fluorobenzoic acid
Also Known As: 3-Carboxy-4-fluorophenylboronic acid, 5-borono-2-fluorobenzoic acid, 3-Carboxy-4-fluorobenzeneboronic acid, 4-fluoro-3-carboxyphenylboronic acid, akos brn-0540
| Molecular Formula | C7H6BFO4 |
|---|---|
| Molecular Weight | 184.03 g/mol |
| LogP | -0.7963 |
| Topological Polar Surface Area | 77.76 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 184.03432 |
| Heavy Atoms | 13 |
| Complexity | 339.26447 |
Chemical Identifiers
| CAS Number | 5211-06-3 |
|---|---|
| SMILES | B(C1=CC(=C(C=C1)F)C(=O)O)(O)O |
Product Overview
3-Carboxy-4-fluorophenylboronic Acid (CAS 5211-06-3), with molecular formula C7H6BFO4 and molecular weight 184.03 g/mol. IUPAC: 5-borono-2-fluorobenzoic acid.
Chemical Property Profile of 3-Carboxy-4-fluorophenylboronic Acid
Property Insights of 3-Carboxy-4-fluorophenylboronic Acid
The XLogP value of -0.7963 indicates that 3-Carboxy-4-fluorophenylboronic Acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 77.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Carboxy-4-fluorophenylboronic Acid. Following Lipinski's Rule of Five, 3-Carboxy-4-fluorophenylboronic Acid has 3 hydrogen bond donor(s) and 3 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 3-Carboxy-4-fluorophenylboronic Acid?
The CAS number of 3-Carboxy-4-fluorophenylboronic Acid is 5211-06-3.
What is the molecular formula of 3-Carboxy-4-fluorophenylboronic Acid?
The molecular formula of 3-Carboxy-4-fluorophenylboronic Acid is C7H6BFO4.
What is the molecular weight of 3-Carboxy-4-fluorophenylboronic Acid?
The molecular weight of 3-Carboxy-4-fluorophenylboronic Acid is 184.03 g/mol.
Where can I buy 3-Carboxy-4-fluorophenylboronic Acid?
You can request a quote for 3-Carboxy-4-fluorophenylboronic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Carboxy-4-fluorophenylboronic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Carboxy-4-fluorophenylboronic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.