TL;DR: 4-Methylpyridine-3-Boronic Acid (CAS 148546-82-1) is a chemical compound with molecular formula C6H8BNO2 and molecular weight 137.0648 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-methyl-3-pyridinyl)boronic acid
Also Known As: 4-Methylpyridine-3-Boronic Acid, (4-methylpyridin-3-yl)boronic Acid, null, 4-methylpyridin-3-ylboronic acid, 3-Borono-4-picoline
| Molecular Formula | C6H8BNO2 |
| Molecular Weight | 137.0648 g/mol |
| XLogP | -0.93018 |
| Topological Polar Surface Area (TPSA) | 53.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 137.0648 Da |
| Heavy Atoms | 10 |
| Complexity | 110.0 |
| SMILES | B(C1=C(C=CN=C1)C)(O)O |
| InChIKey | ASXFMIDIRZPCGK-UHFFFAOYSA-N |
The XLogP value of -0.93018 indicates that 4-Methylpyridine-3-Boronic Acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 53.4 Ų, 4-Methylpyridine-3-Boronic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methylpyridine-3-Boronic Acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-Methylpyridine-3-Boronic Acid is 148546-82-1.
The molecular formula of 4-Methylpyridine-3-Boronic Acid is C6H8BNO2.
The molecular weight of 4-Methylpyridine-3-Boronic Acid is 137.0648 g/mol.
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