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CAS 1256359-94-0

:

1,1-Dimethylethyl 4-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-1-carboxylate

Description:
1,1-Dimethylethyl 4-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-1-carboxylate, with the CAS number 1256359-94-0, is a chemical compound characterized by its complex structure, which includes an indole moiety, a carboxylate group, and a boron-containing dioxaborolane. This compound features a chloro substituent that enhances its reactivity and potential applications in organic synthesis. The presence of the dioxaborolane group suggests that it may be involved in boron chemistry, particularly in reactions such as Suzuki coupling, which is significant in the formation of carbon-carbon bonds. The tert-butyl group (1,1-dimethylethyl) contributes to the compound's steric bulk, potentially influencing its solubility and reactivity. Overall, this compound may be of interest in medicinal chemistry and materials science due to its unique structural features and functional groups, which can be tailored for specific applications in drug development or as intermediates in synthetic pathways.
Formula:C19H25BClNO4
InChI:InChI=1S/C19H25BClNO4/c1-17(2,3)24-16(23)22-11-12(15-13(21)9-8-10-14(15)22)20-25-18(4,5)19(6,7)26-20/h8-11H,1-7H3
InChI key:InChIKey=KFBYQSLSUBWFNK-UHFFFAOYSA-N
SMILES:ClC1=C2C(=CN(C(OC(C)(C)C)=O)C2=CC=C1)B3OC(C)(C)C(C)(C)O3
Synonyms:
  • 1H-Indole-1-carboxylic acid, 4-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 4-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-1-carboxylate
  • tert-butyl 4-chloro-3-(tetraMethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-1-carboxylate
  • tert-butyl 4-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indole-1-carboxylate
  • tert-Butyl 4-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-1-carboxylate
  • 1-BOC-4-chloroindole-3-boronic acid, pinacol ester
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