Boronic acid, (1-methyl-1H-indol-2-yl)-


Chemical Name: Boronic acid, (1-methyl-1H-indol-2-yl)-
CAS Number: 191162-40-0
Product Number: AG002F3C(AGN-PC-03U0HR)
Synonyms:
MDL No:
Molecular Formula: C9H10BNO2
Molecular Weight: 174.9922

Identification/Properties


Computed Properties
Molecular Weight:
174.994g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
175.08g/mol
Monoisotopic Mass:
175.08g/mol
Topological Polar Surface Area:
45.4A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
189
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



(1-Methyl-1H-indol-2-yl)boronic acid is a versatile chemical compound widely utilized in organic synthesis processes. It serves as a crucial building block in the creation of various pharmaceuticals, agrochemicals, and materials. This compound is particularly valued for its ability to participate in Suzuki-Miyaura cross-coupling reactions, where it acts as a boron source to facilitate the formation of carbon-carbon bonds. Its compatibility with a wide range of coupling partners makes it an essential tool for the construction of complex molecular structures in drug discovery and materials science. Additionally, (1-Methyl-1H-indol-2-yl)boronic acid has found applications in the synthesis of natural products and functional materials due to its unique reactivity and versatility in organic transformations.