(3-Acetamidophenyl)boronic acid
TL;DR: (3-Acetamidophenyl)boronic acid (CAS 76253-36-6) is a chemical compound with molecular formula C8H10BNO3 and molecular weight 179.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-acetamidophenyl)boronic acid
Also Known As: 3-Acetamidophenylboronic acid, (3-acetamidophenyl)boronic acid, 3-Acetylaminophenylboronic acid, 3-Acetamidobenzeneboronic acid, 3-Acetamidophenylboronicacid
| Molecular Formula | C8H10BNO3 |
|---|---|
| Molecular Weight | 179.08 g/mol |
| LogP | -0.6752 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 179.07538 |
| Heavy Atoms | 13 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 76253-36-6 |
|---|---|
| SMILES | B(C1=CC(=CC=C1)NC(=O)C)(O)O |
| InChIKey | IBTSWKLSEOGJGJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3-Acetamidophenyl)boronic acid (CAS 76253-36-6), with molecular formula C8H10BNO3 and molecular weight 179.08 g/mol. IUPAC: (3-acetamidophenyl)boronic acid.
Chemical Property Profile of (3-Acetamidophenyl)boronic acid
Property Insights of (3-Acetamidophenyl)boronic acid
The XLogP value of -0.6752 indicates that (3-Acetamidophenyl)boronic 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 (3-Acetamidophenyl)boronic acid. Following Lipinski's Rule of Five, (3-Acetamidophenyl)boronic 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
Frequently Asked Questions
What is the CAS number of (3-Acetamidophenyl)boronic acid?
The CAS number of (3-Acetamidophenyl)boronic acid is 76253-36-6.
What is the molecular formula of (3-Acetamidophenyl)boronic acid?
The molecular formula of (3-Acetamidophenyl)boronic acid is C8H10BNO3.
What is the molecular weight of (3-Acetamidophenyl)boronic acid?
The molecular weight of (3-Acetamidophenyl)boronic acid is 179.08 g/mol.
Where can I buy (3-Acetamidophenyl)boronic acid?
You can request a quote for (3-Acetamidophenyl)boronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Acetamidophenyl)boronic acid?
Yes, KEHONG BIO provides custom synthesis services for (3-Acetamidophenyl)boronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.