Boronic acid, [4-methoxy-3-(trifluoromethyl)phenyl]-


Chemical Name: Boronic acid, [4-methoxy-3-(trifluoromethyl)phenyl]-
CAS Number: 149507-36-8
Product Number: AG001LSA(AGN-PC-01LQVY)
Synonyms:
MDL No:
Molecular Formula: C8H8BF3O3
Molecular Weight: 219.9535

Identification/Properties


Computed Properties
Molecular Weight:
219.954g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
220.052g/mol
Monoisotopic Mass:
220.052g/mol
Topological Polar Surface Area:
49.7A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
210
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



The (4-Methoxy-3-(trifluoromethyl)phenyl)boronic acid is widely utilized in chemical synthesis as a versatile building block in organic chemistry. This compound serves as a key reagent in the construction of various organic molecules, particularly in the field of medicinal chemistry and material science. With its unique structure and properties, (4-Methoxy-3-(trifluoromethyl)phenyl)boronic acid facilitates the formation of complex molecular structures through Suzuki-Miyaura cross-coupling reactions, enabling the synthesis of biologically active compounds, pharmaceuticals, and advanced materials with enhanced properties. In addition to its role in organic synthesis, this boronic acid derivative also finds application as a valuable intermediate in the production of specialty chemicals and agrochemicals. Its compatibility with a diverse range of functional groups and its ability to participate in diverse chemical transformations make it a valuable tool for synthetic chemists exploring new avenues in the development of novel molecules and materials.