Boronic acid, (2,6-difluoro-4-methoxyphenyl)-


Chemical Name: Boronic acid, (2,6-difluoro-4-methoxyphenyl)-
CAS Number: 406482-20-0
Product Number: AG00I7Z4(AGN-PC-00UQFE)
Synonyms:
MDL No:
Molecular Formula: C7H7BF2O3
Molecular Weight: 187.9365

Identification/Properties


Computed Properties
Molecular Weight:
187.937g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
188.046g/mol
Monoisotopic Mass:
188.046g/mol
Topological Polar Surface Area:
49.7A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
158
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:
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



2,6-Difluoro-4-methoxyphenylboronic acid is a versatile compound widely used in chemical synthesis as a key building block in the production of various pharmaceuticals, agrochemicals, and advanced materials. In organic chemistry, this compound serves as a valuable reagent for Suzuki-Miyaura cross-coupling reactions, allowing for the efficient formation of carbon-carbon bonds. Additionally, its unique molecular structure enables selective functionalization at the boronic acid moiety, making it a valuable tool in the synthesis of complex molecules with desired properties. The presence of both fluorine and methoxy groups in its structure imparts specific electronic and steric effects, further enhancing its utility in fine chemical synthesis.