CAS 1072812-81-7

7-Ethoxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole

Description:

7-Ethoxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole is a chemical compound characterized by its unique structure, which includes an indole moiety and a boron-containing dioxaborolane group. The presence of the ethoxy group enhances its solubility in organic solvents, making it suitable for various applications in organic synthesis and medicinal chemistry. The dioxaborolane unit is notable for its ability to participate in boron chemistry, particularly in reactions involving nucleophiles and electrophiles, which can facilitate the formation of carbon-boron bonds. This compound may exhibit interesting biological activities due to the indole structure, which is known for its presence in many natural products and pharmaceuticals. Additionally, the sterically hindered boron center can influence reactivity and selectivity in chemical reactions. Overall, 7-Ethoxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole represents a versatile building block in synthetic chemistry, with potential implications in drug development and materials science.

Formula: C₁₆H₂₂BNO₃

InChI: InChI=1S/C16H22BNO3/c1-6-19-12-9-7-8-11-10-13(18-14(11)12)17-20-15(2,3)16(4,5)21-17/h7-10,18H,6H2,1-5H3

InChI key: InChIKey=RIKUKWAHWCIYBG-UHFFFAOYSA-N

SMILES: O(CC)C1=C2C(C=C(N2)B3OC(C)(C)C(C)(C)O3)=CC=C1

Synonyms:

• 1H-Indole, 7-ethoxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
• 7-Ethoxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole