3-Fluoro-2-methylphenylboronic Acid
TL;DR: 3-Fluoro-2-methylphenylboronic Acid (CAS 163517-61-1) is a chemical compound with molecular formula C7H8BFO2 and molecular weight 154.06013 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-fluoro-2-methylphenyl)boronic acid
Also Known As: (3-fluoro-2-methylphenyl)boronic acid, 3-FLUORO-2-METHYLPHENYLBORONIC ACID, 2-Methyl-3-fluoro-phenylboronic acid, 2-Borono-6-fluorotoluene, (3-fluoro-2-methyl-phenyl)boronic Acid
Technical Specifications
| Molecular Formula | C7H8BFO2 |
| Molecular Weight | 154.06013 g/mol |
| XLogP | -0.18608 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 154.06013 Da |
| Heavy Atoms | 11 |
| Complexity | 132.0 |
| SMILES | B(C1=C(C(=CC=C1)F)C)(O)O |
| InChIKey | NYBIUWJUWTUGFV-UHFFFAOYSA-N |
Chemical Property Profile of 3-Fluoro-2-methylphenylboronic Acid
Property Insights of 3-Fluoro-2-methylphenylboronic Acid
The XLogP value of -0.18608 indicates that 3-Fluoro-2-methylphenylboronic Acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.5 Ų, 3-Fluoro-2-methylphenylboronic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Fluoro-2-methylphenylboronic Acid has 2 hydrogen bond donor(s) and 3 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-Fluoro-2-methylphenylboronic Acid?
The CAS number of 3-Fluoro-2-methylphenylboronic Acid is 163517-61-1.
What is the molecular formula of 3-Fluoro-2-methylphenylboronic Acid?
The molecular formula of 3-Fluoro-2-methylphenylboronic Acid is C7H8BFO2.
What is the molecular weight of 3-Fluoro-2-methylphenylboronic Acid?
The molecular weight of 3-Fluoro-2-methylphenylboronic Acid is 154.06013 g/mol.
Where can I buy 3-Fluoro-2-methylphenylboronic Acid?
You can request a quote for 3-Fluoro-2-methylphenylboronic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Fluoro-2-methylphenylboronic Acid?
Yes, CoreyChem provides custom synthesis services for 3-Fluoro-2-methylphenylboronic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.