Boronic acid, (2-ethoxyphenyl)-


Chemical Name: Boronic acid, (2-ethoxyphenyl)-
CAS Number: 213211-69-9
Product Number: AG00I43O(AGN-PC-07HAGI)
Synonyms:
MDL No: MFCD00674027
Molecular Formula: C8H11BO3
Molecular Weight: 165.9821

Identification/Properties


Properties
MP:
97-102 °C(lit.)
BP:
328.8°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
165.983g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
166.08g/mol
Monoisotopic Mass:
166.08g/mol
Topological Polar Surface Area:
49.7A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
130
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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Chemical Structure



2-Ethoxyphenylboronic acid, also known as 2-phenylboronic acid ethyl ester, is a versatile chemical reagent commonly used in organic synthesis. It serves as a key building block in the formation of carbon-carbon and carbon-heteroatom bonds, making it an essential tool in the field of medicinal chemistry, material science, and agrochemical research.One of the primary applications of 2-Ethoxyphenylboronic acid is as a crucial component in Suzuki-Miyaura cross-coupling reactions. This powerful synthetic method allows for the construction of complex organic molecules by joining two different functional groups under mild reaction conditions. By acting as a boronate ester partner in these reactions, 2-Ethoxyphenylboronic acid facilitates the formation of biaryl compounds, which are prevalent in pharmaceuticals, natural products, and materials chemistry.Furthermore, 2-Ethoxyphenylboronic acid exhibits excellent regio- and stereo-selectivity in various transformations, making it a valuable tool for the selective functionalization of aromatic rings. Its ability to participate in metal-catalyzed coupling reactions, such as palladium-catalyzed cross-couplings, enables chemists to modify the structure of organic molecules with precision, opening up pathways to novel chemical entities with diverse properties and functionalities.In summary, 2-Ethoxyphenylboronic acid plays a pivotal role in modern chemical synthesis by enabling the efficient construction of complex molecules and facilitating the discovery of new materials and bioactive compounds. Its versatile applications make it a go-to reagent for synthetic chemists seeking to explore the frontiers of chemical research and innovation.