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CAS 837392-61-7

:

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

Description:
5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)-1H-indole is a chemical compound characterized by its unique structural features, which include an indole core substituted with a trifluoromethyl group and a boron-containing dioxaborolane moiety. The presence of the trifluoromethyl group enhances the compound's lipophilicity and can influence its electronic properties, making it potentially useful in various applications, including pharmaceuticals and agrochemicals. The dioxaborolane group is known for its ability to participate in boron chemistry, which can facilitate reactions such as Suzuki coupling, making this compound valuable in synthetic organic chemistry. Additionally, the steric bulk provided by the tetramethyl substituents can affect the compound's reactivity and stability. Overall, this compound exemplifies the intersection of boron chemistry and heterocyclic compounds, showcasing properties that may be exploited in advanced material science and medicinal chemistry.
Formula:C15H17BF3NO2
InChI:InChI=1S/C15H17BF3NO2/c1-13(2)14(3,4)22-16(21-13)10-5-6-11-9(7-10)8-12(20-11)15(17,18)19/h5-8,20H,1-4H3
InChI key:InChIKey=RKTJALSAZJUXFA-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=CC=2C(N1)=CC=C(C2)B3OC(C)(C)C(C)(C)O3
Synonyms:
  • 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)-1H-indole
  • 1H-Indole, 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)-
  • 5-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)-2-trifluoromethyl-1H-indole
  • 2-Trifluoromethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole
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