(4-methylsulfonyloxyphenyl)boronic acid


Chemical Name: (4-methylsulfonyloxyphenyl)boronic acid
CAS Number: 957035-04-0
Product Number: AG00IJD8(AGN-PC-0712PX)
Synonyms:
MDL No:
Molecular Formula: C7H9BO5S
Molecular Weight: 216.0194

Identification/Properties


Computed Properties
Molecular Weight:
216.014g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
216.026g/mol
Monoisotopic Mass:
216.026g/mol
Topological Polar Surface Area:
92.2A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
262
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

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



(4-((Methylsulfonyl)oxy)phenyl)boronic acid is a versatile chemical compound widely used in organic synthesis. Its primary application lies in Suzuki-Miyaura cross-coupling reactions, where it serves as a key reagent for forming carbon-carbon bonds. This compound is particularly valuable in the construction of complex organic molecules, such as pharmaceuticals, agrochemicals, and organic materials. Additionally, (4-((Methylsulfonyl)oxy)phenyl)boronic acid can be utilized in the synthesis of functional materials, catalysts, and advanced polymers. Its high reactivity and compatibility with a wide range of functional groups make it a valuable tool for chemists seeking to create new and innovative molecules.