3-Carboxy-2-fluorophenylboronic acid
TL;DR: 3-Carboxy-2-fluorophenylboronic acid (CAS 1072952-09-0) is a chemical compound with molecular formula C7H6BFO4 and molecular weight 184.03432 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-borono-2-fluorobenzoic acid
Also Known As: 3-borono-2-fluorobenzoic acid, 3-CARBOXY-2-FLUOROPHENYLBORONIC ACID, 3-borono-2-fluoro-benzoic Acid, 2-Fluoro-3-carboxyphenylboronic acid, 3-Borono-2-fluorobenzoicacid
Technical Specifications
| Molecular Formula | C7H6BFO4 |
| Molecular Weight | 184.03432 g/mol |
| XLogP | -0.7963 |
| Topological Polar Surface Area (TPSA) | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 184.03432 Da |
| Heavy Atoms | 13 |
| Complexity | 199.0 |
| SMILES | B(C1=C(C(=CC=C1)C(=O)O)F)(O)O |
| InChIKey | DLSFOCMCMFDBOG-UHFFFAOYSA-N |
Chemical Property Profile of 3-Carboxy-2-fluorophenylboronic acid
Property Insights of 3-Carboxy-2-fluorophenylboronic acid
The XLogP value of -0.7963 indicates that 3-Carboxy-2-fluorophenylboronic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Carboxy-2-fluorophenylboronic acid. Following Lipinski's Rule of Five, 3-Carboxy-2-fluorophenylboronic acid has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Carboxy-2-fluorophenylboronic acid?
The CAS number of 3-Carboxy-2-fluorophenylboronic acid is 1072952-09-0.
What is the molecular formula of 3-Carboxy-2-fluorophenylboronic acid?
The molecular formula of 3-Carboxy-2-fluorophenylboronic acid is C7H6BFO4.
What is the molecular weight of 3-Carboxy-2-fluorophenylboronic acid?
The molecular weight of 3-Carboxy-2-fluorophenylboronic acid is 184.03432 g/mol.
Where can I buy 3-Carboxy-2-fluorophenylboronic acid?
You can request a quote for 3-Carboxy-2-fluorophenylboronic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Carboxy-2-fluorophenylboronic acid?
Yes, CoreyChem provides custom synthesis services for 3-Carboxy-2-fluorophenylboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.