TL;DR: (2,3-Difluoro-6-hydroxyphenyl)boronic acid (CAS 1238196-62-7) is a chemical compound with molecular formula C6H5BF2O3 and molecular weight 174.02998 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2,3-difluoro-6-hydroxyphenyl)boronic acid
Also Known As: (2,3-difluoro-6-hydroxyphenyl)boronic acid, 2,3-Difluoro-6-hydroxyphenylboronic acid, B-(2,3-Difluoro-6-hydroxyphenyl)boronic acid, (2,3-difluoro-6-hydroxy-phenyl)boronic Acid, B-(2,3-DIFLUORO-6-HYDROXYPHENYL)-BORONIC ACID
| Molecular Formula | C6H5BF2O3 |
| Molecular Weight | 174.02998 g/mol |
| XLogP | -0.6498 |
| Topological Polar Surface Area (TPSA) | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.02998 Da |
| Heavy Atoms | 12 |
| Complexity | 158.0 |
| SMILES | B(C1=C(C=CC(=C1F)F)O)(O)O |
| InChIKey | KOWZIVQZEGPNSW-UHFFFAOYSA-N |
The XLogP value of -0.6498 indicates that (2,3-Difluoro-6-hydroxyphenyl)boronic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (2,3-Difluoro-6-hydroxyphenyl)boronic acid. Following Lipinski's Rule of Five, (2,3-Difluoro-6-hydroxyphenyl)boronic acid has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2,3-Difluoro-6-hydroxyphenyl)boronic acid is 1238196-62-7.
The molecular formula of (2,3-Difluoro-6-hydroxyphenyl)boronic acid is C6H5BF2O3.
The molecular weight of (2,3-Difluoro-6-hydroxyphenyl)boronic acid is 174.02998 g/mol.
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