2-Bromo-6-fluorophenylboronic acid


Chemical Name: 2-Bromo-6-fluorophenylboronic acid
CAS Number: 913835-80-0
Product Number: AG00IGMT(AGN-PC-00UQFZ)
Synonyms:
MDL No:
Molecular Formula: C6H5BBrFO2
Molecular Weight: 218.8161

Identification/Properties


Computed Properties
Molecular Weight:
218.816g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
217.955g/mol
Monoisotopic Mass:
217.955g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
136
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

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NMR Spectrum


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Chemical Structure



(2-Bromo-6-fluorophenyl)boronic acid is a versatile chemical compound widely used in organic synthesis as a key building block. It plays a crucial role in various reactions, including Suzuki-Miyaura coupling, palladium-catalyzed cross-coupling reactions, and metal-catalyzed arylations. This compound serves as a valuable source of the 2-bromo-6-fluorophenyl group, enabling the introduction of specific functionalities into organic molecules. Its unique structure and reactivity make it an essential tool for creating complex organic compounds in medicinal chemistry, materials science, and agrochemical synthesis.