N-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]formamide


Chemical Name: N-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]formamide
CAS Number: 480425-36-3
Product Number: AG00D9RF(AGN-PC-0KKVUK)
Synonyms:
MDL No:
Molecular Formula: C13H18BNO3
Molecular Weight: 247.09792

Identification/Properties


Computed Properties
Molecular Weight:
247.101g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
247.138g/mol
Monoisotopic Mass:
247.138g/mol
Topological Polar Surface Area:
47.6A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
303
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



Formamide, N-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- is a crucial compound in chemical synthesis, particularly in the realm of organic chemistry. This compound serves as an essential building block in the creation of various organic molecules due to its unique reactivity and versatile nature.One of the primary applications of Formamide, N-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- is in the field of cross-coupling reactions, where it acts as a key reagent in Suzuki-Miyaura coupling reactions. This process involves the formation of carbon-carbon bonds between an aryl halide and an organoboron compound, catalyzed by palladium. The presence of the boron functionality in Formamide facilitates the coupling reaction, leading to the formation of complex organic structures.Additionally, Formamide, N-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- is utilized in the synthesis of biaryl compounds, which are prevalent in pharmaceuticals, agrochemicals, and materials science. By enabling the construction of biaryl linkages, this compound plays a crucial role in the development of new drug candidates, functional materials, and advanced molecular architectures.Overall, Formamide, N-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]- is a valuable tool in the hands of synthetic chemists, offering a pathway to the creation of diverse and intricate organic molecules with potential applications across various scientific disciplines.