[3-(1,3-dioxolan-2-yl)-5-(trifluoromethyl)phenyl]boronic acid


Chemical Name: [3-(1,3-dioxolan-2-yl)-5-(trifluoromethyl)phenyl]boronic acid
CAS Number: 1072946-51-0
Product Number: AG003BQ2(AGN-PC-07XTYL)
Synonyms:
MDL No:
Molecular Formula: C10H10BF3O4
Molecular Weight: 261.9902

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
261.991g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
2
Exact Mass:
262.062g/mol
Monoisotopic Mass:
262.062g/mol
Topological Polar Surface Area:
58.9A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
281
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



The (3-(1,3-Dioxolan-2-yl)-5-(trifluoromethyl)phenyl)boronic acid is a versatile chemical compound widely utilized in modern chemical synthesis processes. This boronic acid derivative serves as a valuable building block for the construction of complex organic molecules due to its unique structural and reactive properties. In chemical synthesis, this compound is commonly employed as a key reagent in Suzuki-Miyaura cross-coupling reactions, enabling the efficient formation of carbon-carbon bonds under mild reaction conditions. Additionally, the (3-(1,3-Dioxolan-2-yl)-5-(trifluoromethyl)phenyl)boronic acid has found applications in the synthesis of pharmaceuticals, agrochemicals, and materials science, showcasing its importance in the development of novel chemical entities with diverse functionalities and applications.