(2,3,5-trifluorophenyl)boronic acid


Chemical Name: (2,3,5-trifluorophenyl)boronic acid
CAS Number: 247564-73-4
Product Number: AG002PC5(AGN-PC-0L4YFT)
Synonyms:
MDL No:
Molecular Formula: C6H4BF3O2
Molecular Weight: 175.9010

Identification/Properties


Properties
MP:
127-132 °C(lit.);
BP:
269.3°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
175.901g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
176.026g/mol
Monoisotopic Mass:
176.026g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
12
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#:
-
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



Boronic acid, B-(2,3,5-trifluorophenyl)-, is a versatile reagent commonly used in chemical synthesis. Its unique properties make it a valuable tool for organic chemists seeking to create complex molecules. This particular boronic acid derivative is especially useful in Suzuki-Miyaura cross-coupling reactions, where it serves as a key component in forming carbon-carbon bonds. The electron-withdrawing trifluorophenyl group enhances the reactivity of the boronic acid, making it particularly effective for coupling with a wide range of aryl halides and pseudohalides. This compound plays a crucial role in the synthesis of pharmaceuticals, agrochemicals, and materials with tailored properties. Its high purity ensures consistent and reliable results in synthetic chemistry research and development.