4-Acetamidophenylboronic acid
TL;DR: 4-Acetamidophenylboronic acid (CAS 101251-09-6) is a chemical compound with molecular formula C8H10BNO3 and molecular weight 179.07538 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-acetamidophenyl)boronic acid
Also Known As: 4-Acetamidophenylboronic acid, 4-acetylaminophenylboronic acid, (4-acetamidophenyl)boronic Acid, null, 4-acetamidophenyl boronic acid
Technical Specifications
| Molecular Formula | C8H10BNO3 |
| Molecular Weight | 179.07538 g/mol |
| XLogP | -0.6752 |
| Topological Polar Surface Area (TPSA) | 69.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 179.07538 Da |
| Heavy Atoms | 13 |
| Complexity | 178.0 |
| SMILES | B(C1=CC=C(C=C1)NC(=O)C)(O)O |
| InChIKey | VYEWTHXZHHATTA-UHFFFAOYSA-N |
Chemical Property Profile of 4-Acetamidophenylboronic acid
Property Insights of 4-Acetamidophenylboronic acid
The XLogP value of -0.6752 indicates that 4-Acetamidophenylboronic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Acetamidophenylboronic acid. Following Lipinski's Rule of Five, 4-Acetamidophenylboronic 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
What is the CAS number of 4-Acetamidophenylboronic acid?
The CAS number of 4-Acetamidophenylboronic acid is 101251-09-6.
What is the molecular formula of 4-Acetamidophenylboronic acid?
The molecular formula of 4-Acetamidophenylboronic acid is C8H10BNO3.
What is the molecular weight of 4-Acetamidophenylboronic acid?
The molecular weight of 4-Acetamidophenylboronic acid is 179.07538 g/mol.
Where can I buy 4-Acetamidophenylboronic acid?
You can request a quote for 4-Acetamidophenylboronic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Acetamidophenylboronic acid?
Yes, CoreyChem provides custom synthesis services for 4-Acetamidophenylboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.