[3-(methoxycarbamoyl)phenyl]boronic acid


Chemical Name: [3-(methoxycarbamoyl)phenyl]boronic acid
CAS Number: 850567-26-9
Product Number: AG004PCJ(AGN-PC-0712TP)
Synonyms:
MDL No:
Molecular Formula: C8H10BNO4
Molecular Weight: 194.9803

Identification/Properties


Properties
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
194.981g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
195.07g/mol
Monoisotopic Mass:
195.07g/mol
Topological Polar Surface Area:
78.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
200
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 (3-(Methoxycarbamoyl)phenyl)boronic acid is a vital organic compound widely utilized in chemical synthesis processes. This versatile compound acts as a key building block in the creation of various pharmaceuticals, agrochemicals, and materials. Its unique structure containing both a boronic acid and a carbamoyl group allows for efficient coupling reactions with a variety of substrates.In chemical synthesis, (3-(Methoxycarbamoyl)phenyl)boronic acid serves as a valuable reagent for Suzuki-Miyaura cross-coupling reactions. This reaction involves the coupling of an aryl or vinyl boronic acid with an organic halide or pseudohalide under the influence of a palladium catalyst. The resulting products are essential intermediates in the synthesis of complex organic molecules such as natural products, pharmaceuticals, and functional materials.Furthermore, the boronic acid functionality in this compound enables it to participate in diverse transformations like Suzuki-Miyaura coupling, Sonogashira coupling, and Chan-Lam coupling reactions. These reactions are crucial for the construction of carbon-carbon and carbon-heteroatom bonds, facilitating the creation of intricate molecular structures with high efficiency and selectivity.Overall, the (3-(Methoxycarbamoyl)phenyl)boronic acid plays a pivotal role in modern organic synthesis by enabling the formation of complex chemical entities through precise and controlled bond-forming processes. Its versatility and reactivity make it a valuable tool for chemists to access a wide range of functionalized molecules with potential applications in various fields, including medicine, agriculture, and materials science.