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CAS 944401-58-5

:

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

Description:
5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-2-pyrimidinamine is a chemical compound characterized by its unique structural features, which include a pyrimidine ring substituted with a trifluoromethyl group and a boron-containing moiety. The presence of the dioxaborolane group contributes to its potential reactivity and utility in various chemical reactions, particularly in organoboron chemistry. This compound is likely to exhibit properties typical of pyrimidine derivatives, such as moderate solubility in organic solvents and potential biological activity, making it of interest in medicinal chemistry. The trifluoromethyl group is known to enhance lipophilicity and metabolic stability, which can influence the compound's pharmacokinetic properties. Additionally, the presence of the boron atom may facilitate coordination with other molecules, potentially leading to applications in catalysis or as a building block in the synthesis of more complex organic compounds. Overall, this compound represents a versatile structure with potential applications in both research and industry.
Formula:C11H15BF3N3O2
InChI:InChI=1S/C11H15BF3N3O2/c1-9(2)10(3,4)20-12(19-9)6-5-17-8(16)18-7(6)11(13,14)15/h5H,1-4H3,(H2,16,17,18)
InChI key:InChIKey=FEVSQCNVVXXUBK-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C=1C(B2OC(C)(C)C(C)(C)O2)=CN=C(N)N1
Synonyms:
  • 2-Amino-4-(trifluoromethyl)pyrimidine-5-boronic acid pinacol ester
  • 2-Amino-4-trifluoromethylpyrimidine-5-boronic acid pinacol ester
  • 2-Pyrimidinamine, 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-
  • 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)-2-pyrimidinamine
  • [5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyrimidin-2-yl]amine
  • 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyrimidin-2-amine
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