(2-BOC-aminophenyl)boronic acid
TL;DR: (2-BOC-aminophenyl)boronic acid (CAS 115377-94-1) is a chemical compound with molecular formula C11H16BNO4 and molecular weight 237.11723 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]boronic acid
Also Known As: 2-BOC-aminophenylboronic acid, (2-BOC-AMINOPHENYL)BORONIC ACID, (2-((tert-Butoxycarbonyl)amino)phenyl)boronic acid, 2-(Boc-amino)phenylboronic acid, N-(tert-Butoxycarbonyl)-2-amino-1-phenylboronic acid
Technical Specifications
| Molecular Formula | C11H16BNO4 |
| Molecular Weight | 237.11723 g/mol |
| XLogP | 0.7134 |
| Topological Polar Surface Area (TPSA) | 78.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 237.11723 Da |
| Heavy Atoms | 17 |
| Complexity | 265.0 |
| SMILES | B(C1=CC=CC=C1NC(=O)OC(C)(C)C)(O)O |
| InChIKey | RMEIKYSECODAHJ-UHFFFAOYSA-N |
Chemical Property Profile of (2-BOC-aminophenyl)boronic acid
Property Insights of (2-BOC-aminophenyl)boronic acid
The XLogP value of 0.7134 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-BOC-aminophenyl)boronic acid. The TPSA of 78.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-BOC-aminophenyl)boronic acid. Following Lipinski's Rule of Five, (2-BOC-aminophenyl)boronic acid has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2-BOC-aminophenyl)boronic acid?
The CAS number of (2-BOC-aminophenyl)boronic acid is 115377-94-1.
What is the molecular formula of (2-BOC-aminophenyl)boronic acid?
The molecular formula of (2-BOC-aminophenyl)boronic acid is C11H16BNO4.
What is the molecular weight of (2-BOC-aminophenyl)boronic acid?
The molecular weight of (2-BOC-aminophenyl)boronic acid is 237.11723 g/mol.
Where can I buy (2-BOC-aminophenyl)boronic acid?
You can request a quote for (2-BOC-aminophenyl)boronic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2-BOC-aminophenyl)boronic acid?
Yes, CoreyChem provides custom synthesis services for (2-BOC-aminophenyl)boronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.