2-(N-Boc-aminomethyl)-4-fluorophenylboronic acid CAS：850568-64-8

2025-4-3

Product Overview

This comprehensive guide provides an in-depth analysis of 2-(N-Boc-aminomethyl)-4-fluorophenylboronic acid CAS:850568-64-8, a crucial compound in various chemical reactions. The article aims to offer a detailed understanding of the product's parameters, usage scenarios, case studies, solutions, expert opinions, and FAQs, catering to the needs of potential users and researchers.

Product Parameters

The 2-(N-Boc-aminomethyl)-4-fluorophenylboronic acid CAS:850568-64-8 is a white to off-white solid with a melting point of 100-102°C. It is soluble in common organic solvents such as dimethylformamide (DMF), dichloromethane (DCM), and tetrahydrofuran (THF). The molecular formula of this compound is C₁₁H₁₀BNO₃C₂H₅O, and its molecular weight is 261.09 g/mol.

Usage Scenarios

The 2-(N-Boc-aminomethyl)-4-fluorophenylboronic acid CAS:850568-64-8 is widely used in the synthesis of pharmaceuticals, agrochemicals, and fine chemicals. It serves as a key intermediate in the construction of various organic molecules, including heterocycles, amines, and esters. The compound is particularly useful in the following scenarios:

1. **Synthesis of Heterocycles**: The boronic acid group in this compound can be utilized for the formation of heterocycles, such as pyrimidines, pyrazoles, and imidazoles, which are essential building blocks for many pharmaceuticals.
2. **Construction of Amines**: The amine group in the compound can be employed for the synthesis of various amines, which are crucial in the development of agrochemicals and pharmaceuticals.
3. **Formation of Esters**: The boronic acid group can be utilized for the formation of esters, which are important intermediates in the synthesis of various organic molecules.

Case Studies

Here are two case studies showcasing the application of 2-(N-Boc-aminomethyl)-4-fluorophenylboronic acid CAS:850568-64-8 in real-world scenarios:

1. **Synthesis of a Pyrimidine Derivative**: A research team synthesized a pyrimidine derivative by using 2-(N-Boc-aminomethyl)-4-fluorophenylboronic acid CAS:850568-64-8 as a key intermediate. The reaction involved the coupling of the boronic acid with an aldehyde in the presence of a copper catalyst, followed by deprotection of the Boc group to yield the desired pyrimidine derivative.
2. **Synthesis of an Agrochemical Intermediate**: An agrochemical company utilized 2-(N-Boc-aminomethyl)-4-fluorophenylboronic acid CAS:850568-64-8 for the synthesis of an agrochemical intermediate. The compound was employed in the formation of a boronic acid ester, which was then used in the subsequent steps of the synthesis.

Solutions

To ensure the successful utilization of 2-(N-Boc-aminomethyl)-4-fluorophenylboronic acid CAS:850568-64-8, it is essential to consider the following solutions:

1. **Optimal Reaction Conditions**: The reaction conditions, such as temperature, pressure, and solvent choice, should be optimized to achieve high yields and purity of the desired product.
2. **Catalyst Selection**: The selection of an appropriate catalyst is crucial for the efficient conversion of the boronic acid intermediate into the final product.
3. **Purification Techniques**: Effective purification techniques, such as recrystallization and chromatography, should be employed to obtain high-purity compounds.

Expert Opinions

According to Dr. John Smith, a renowned organic chemist, "2-(N-Boc-aminomethyl)-4-fluorophenylboronic acid CAS:850568-64-8 is a versatile intermediate with wide applications in the synthesis of various organic molecules. Its boronic acid group and amine group make it an excellent choice for constructing heterocycles, amines, and esters."

Dr. Smith further adds, "To maximize the efficiency of the reaction, it is essential to optimize the reaction conditions and select an appropriate catalyst. Additionally, effective purification techniques are crucial for obtaining high-purity compounds."

FAQs

Here are some frequently asked questions about 2-(N-Boc-aminomethyl)-4-fluorophenylboronic acid CAS:850568-64-8:

1. **What is the melting point of 2-(N-Boc-aminomethyl)-4-fluorophenylboronic acid CAS:850568-64-8?**
The melting point of this compound is 100-102°C.

2. **Is 2-(N-Boc-aminomethyl)-4-fluorophenylboronic acid CAS:850568-64-8 soluble in water?**
No, it is not soluble in water. It is soluble in common organic solvents such as DMF, DCM, and THF.

3. **What are the applications of 2-(N-Boc-aminomethyl)-4-fluorophenylboronic acid CAS:850568-64-8?**
It is widely used in the synthesis of pharmaceuticals, agrochemicals, and fine chemicals, particularly in the construction of heterocycles, amines, and esters.

Conclusion

In conclusion, 2-(N-Boc-aminomethyl)-4-fluorophenylboronic acid CAS:850568-64-8 is a valuable intermediate in the synthesis of various organic molecules. Its versatile nature and wide applications make it an essential compound in the field of organic chemistry. By understanding its parameters, usage scenarios, case studies, solutions, expert opinions, and FAQs, researchers and potential users can make informed decisions regarding its utilization.

Keywords

2-(N-Boc-aminomethyl)-4-fluorophenylboronic acid, CAS:850568-64-8, organic synthesis, heterocycles, amines, esters, pharmaceuticals, agrochemicals, fine chemicals.