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CAS 1204334-20-2

:

4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-3,5-bis(trifluoromethyl)-1H-pyrazole

Description:
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-3,5-bis(trifluoromethyl)-1H-pyrazole is a chemical compound characterized by its unique structural features, including a pyrazole ring and a dioxaborolane moiety. The presence of trifluoromethyl groups enhances its lipophilicity and may influence its reactivity and biological activity. The dioxaborolane group is known for its role in facilitating various chemical transformations, particularly in organoboron chemistry, making this compound potentially useful in synthetic applications. The compound's molecular structure suggests it may exhibit interesting properties such as stability under certain conditions, potential for coordination with metal ions, and reactivity in nucleophilic substitution reactions. Additionally, the presence of fluorine atoms typically imparts unique electronic properties, which can affect the compound's interaction with biological targets. Overall, this compound may find applications in medicinal chemistry, agrochemicals, or materials science, although specific applications would depend on further research into its properties and behavior in various environments.
Formula:C11H13BF6N2O2
InChI:InChI=1S/C11H13BF6N2O2/c1-8(2)9(3,4)22-12(21-8)5-6(10(13,14)15)19-20-7(5)11(16,17)18/h1-4H3,(H,19,20)
InChI key:InChIKey=CLZOYAKINXVSHM-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C=1C(=C(C(F)(F)F)NN1)B2OC(C)(C)C(C)(C)O2
Synonyms:
  • 1H-Pyrazole, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,5-bis(trifluoromethyl)-
  • 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-3,5-bis(trifluoromethyl)-1H-pyrazole
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