4-Aminocarbonylphenylboronic acid
TL;DR: 4-Aminocarbonylphenylboronic acid (CAS 101051-09-6) is a chemical compound with molecular formula C7H8BNO3 and molecular weight 165.05972 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-carbamoylphenyl)boronic acid
Also Known As: 4-Aminocarbonylphenylboronic acid, 4-Carbamoylphenylboronic acid, (4-carbamoylphenyl)boronic Acid, benzamide-4-boronic acid, 4-carbamoylbenzeneboronic acid
Technical Specifications
| Molecular Formula | C7H8BNO3 |
| Molecular Weight | 165.05972 g/mol |
| XLogP | -1.5347 |
| Topological Polar Surface Area (TPSA) | 83.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 165.05972 Da |
| Heavy Atoms | 12 |
| Complexity | 166.0 |
| SMILES | B(C1=CC=C(C=C1)C(=O)N)(O)O |
| InChIKey | GNRHNKBJNUVWFZ-UHFFFAOYSA-N |
Chemical Property Profile of 4-Aminocarbonylphenylboronic acid
Property Insights of 4-Aminocarbonylphenylboronic acid
The XLogP value of -1.5347 indicates that 4-Aminocarbonylphenylboronic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Aminocarbonylphenylboronic acid. Following Lipinski's Rule of Five, 4-Aminocarbonylphenylboronic 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-Aminocarbonylphenylboronic acid?
The CAS number of 4-Aminocarbonylphenylboronic acid is 101051-09-6.
What is the molecular formula of 4-Aminocarbonylphenylboronic acid?
The molecular formula of 4-Aminocarbonylphenylboronic acid is C7H8BNO3.
What is the molecular weight of 4-Aminocarbonylphenylboronic acid?
The molecular weight of 4-Aminocarbonylphenylboronic acid is 165.05972 g/mol.
Where can I buy 4-Aminocarbonylphenylboronic acid?
You can request a quote for 4-Aminocarbonylphenylboronic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Aminocarbonylphenylboronic acid?
Yes, CoreyChem provides custom synthesis services for 4-Aminocarbonylphenylboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.