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CAS 1218790-26-1

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1,1-Dimethylethyl 7-methoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-1-carboxylate

Description:
1,1-Dimethylethyl 7-methoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-1-carboxylate, with CAS number 1218790-26-1, is a complex organic compound characterized by its indole structure, which is a bicyclic compound consisting of a benzene ring fused to a pyrrole ring. This substance features a carboxylate functional group, indicating its potential for reactivity and interaction with various chemical species. The presence of a methoxy group enhances its solubility in organic solvents and may influence its electronic properties. Additionally, the incorporation of a boron-containing moiety, specifically a dioxaborolane, suggests potential applications in organoboron chemistry, including use in cross-coupling reactions or as a reagent in organic synthesis. The tert-butyl group contributes to the compound's steric bulk, which can affect its reactivity and interaction with biological systems. Overall, this compound's unique structural features may lend it utility in medicinal chemistry or materials science, although specific applications would depend on further research and characterization.
Formula:C20H28BNO5
InChI:InChI=1S/C20H28BNO5/c1-18(2,3)25-17(23)22-12-14(13-10-9-11-15(24-8)16(13)22)21-26-19(4,5)20(6,7)27-21/h9-12H,1-8H3
InChI key:InChIKey=GXVNJKPEAWTIRL-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1C=2C(C(=C1)B3OC(C)(C)C(C)(C)O3)=CC=CC2OC
Synonyms:
  • 1H-Indole-1-carboxylic acid, 7-methoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 7-methoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-1-carboxylate
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