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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

Boronic acid, B-[2-methyl-4-(trifluoromethyl)phenyl]-

OB(c1ccc(cc1C)C(F)(F)F)O Request for Quotation
Chemical Name: Boronic acid, B-[2-methyl-4-(trifluoromethyl)phenyl]-
CAS Number: 957034-45-6
Product Number: AG005Z07(AGN-PC-078TDK)
Synonyms:
MDL No:
Molecular Formula: C8H8BF3O2
Molecular Weight: 203.9541

Identification/Properties

Properties
BP:
271.9°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
203.955g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
204.057g/mol
Monoisotopic Mass:
204.057g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
196
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

NMR Spectrum

Other Analytical Data

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Chemical Structure


2-Methyl-4-(trifluoromethyl)phenylboronic acid, also known as $name$, is a versatile reagent commonly used in organic synthesis. This compound has found widespread application as a key building block in the construction of various pharmaceuticals, agrochemicals, and fine chemicals.In chemical synthesis, 2-Methyl-4-(trifluoromethyl)phenylboronic acid serves as a valuable source of the trifluoromethyl group, which is a highly sought-after motif in medicinal chemistry due to its unique physicochemical properties. This reagent can be used in cross-coupling reactions, such as Suzuki-Miyaura coupling, to introduce the trifluoromethyl group onto a wide range of organic molecules. The resulting trifluoromethylated products often exhibit enhanced biological activities or improved drug-like characteristics.Furthermore, 2-Methyl-4-(trifluoromethyl)phenylboronic acid can also participate in other transformations, such as nucleophilic additions and metal-catalyzed transformations, offering synthetic chemists a powerful tool for the efficient construction of complex molecular structures. Its compatibility with a variety of functional groups makes it a valuable asset in the synthesis of diverse chemical compounds with potential applications in the pharmaceutical and agrochemical industries.