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CAS 2121513-72-0

:

4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzoic acid

Description:
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzoic acid is a chemical compound characterized by its unique structure, which includes a benzoic acid moiety substituted with a trifluoromethyl group and a dioxaborolane ring. The presence of the trifluoromethyl group enhances its lipophilicity and can influence its reactivity and biological activity. The dioxaborolane component contributes to the compound's potential as a boron-containing reagent, which may be useful in various synthetic applications, including organic synthesis and medicinal chemistry. This compound may exhibit interesting properties such as solubility in organic solvents and potential interactions with biological targets due to its functional groups. Additionally, the presence of the boron atom can facilitate coordination with other molecules, making it a candidate for applications in materials science and catalysis. Overall, the combination of these structural features suggests that this compound could have diverse applications in research and industry, particularly in the fields of pharmaceuticals and agrochemicals.
Formula:C14H16BF3O4
InChI:InChI=1S/C14H16BF3O4/c1-12(2)13(3,4)22-15(21-12)8-5-6-9(11(19)20)10(7-8)14(16,17)18/h5-7H,1-4H3,(H,19,20)
InChI key:InChIKey=WGMLHOOENBAYCN-UHFFFAOYSA-N
SMILES:CC1(C)OB(OC1(C)C)C2=CC(C(F)(F)F)=C(C(O)=O)C=C2
Synonyms:
  • 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzoic acid
  • Benzoic acid, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)-
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