Boronic acid, (4'-chloro[1,1'-biphenyl]-4-yl)-


Chemical Name: Boronic acid, (4'-chloro[1,1'-biphenyl]-4-yl)-
CAS Number: 364044-44-0
Product Number: AG00BXM4(AGN-PC-00VAIZ)
Synonyms:
MDL No:
Molecular Formula: C12H10BClO2
Molecular Weight: 232.4706

Identification/Properties


Properties
BP:
411°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
232.47g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
232.046g/mol
Monoisotopic Mass:
232.046g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
209
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-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



The (4'-Chloro-[1,1'-biphenyl]-4-yl)boronic acid is a versatile compound widely used in chemical synthesis due to its unique reactivity and functional group compatibility. Its boronic acid group allows for effective coupling reactions with various functional groups, making it a valuable building block in the synthesis of complex organic molecules. This compound is especially useful in Suzuki-Miyaura cross-coupling reactions, where it serves as a key component in the formation of carbon-carbon bonds. Additionally, (4'-Chloro-[1,1'-biphenyl]-4-yl)boronic acid can be utilized in the preparation of pharmaceuticals, agrochemicals, and materials due to its ability to introduce specific structural motifs into target molecules. Its broad applicability and reliability make it an essential tool for organic chemists in the development of new compounds with tailored properties.