Boronic acid, (5-chloro-2,4-difluorophenyl)-


Chemical Name: Boronic acid, (5-chloro-2,4-difluorophenyl)-
CAS Number: 911645-24-4
Product Number: AG003BXV(AGN-PC-0KZSWT)
Synonyms:
MDL No:
Molecular Formula: C6H4BClF2O2
Molecular Weight: 192.3556

Identification/Properties


Properties
MP:
218-222°C
Storage:
2-8℃;Inert atmosphere;
Form:
Solid
Computed Properties
Molecular Weight:
192.353g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
191.996g/mol
Monoisotopic Mass:
191.996g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
161
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#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



This high-purity sample of (5-Chloro-2,4-difluorophenyl)boronic acid is a versatile reagent commonly used in chemical synthesis. When incorporated into organic reactions, this compound serves as a key building block for the construction of various pharmaceuticals, agrochemicals, and materials. Its unique molecular structure and boronic acid functionality make it especially valuable in Suzuki-Miyuara cross-coupling reactions, enabling the formation of carbon-carbon bonds with high efficiency and selectivity. Furthermore, its halogen substituents provide opportunities for further derivatization, allowing for the synthesis of more complex and diverse molecules. Exemplifying precise composition and superior quality, this (5-Chloro-2,4-difluorophenyl)boronic acid is essential for research and industrial applications demanding advanced synthetic capabilities.