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CAS 501945-71-7

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2-(Benzo[b]thiophen-5-yl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane

Description:
2-(Benzo[b]thiophen-5-yl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane is an organoboron compound characterized by its unique structural features, including a dioxaborolane ring and a benzo[b]thiophene moiety. The presence of the dioxaborolane structure imparts specific reactivity, particularly in cross-coupling reactions, making it valuable in organic synthesis and materials science. The compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its molecular structure suggests potential applications in the development of organic electronic materials, such as OLEDs or organic photovoltaics, due to the conjugated system provided by the benzo[b]thiophene unit. Additionally, the tetramethyl substitution enhances its stability and solubility, which can be advantageous in various chemical reactions. As with many organoboron compounds, it may also participate in reactions involving nucleophiles and electrophiles, making it a versatile building block in synthetic organic chemistry. Safety data and handling precautions should be observed, as with all chemical substances, to ensure safe laboratory practices.
Formula:C14H17BO2S
InChI:InChI=1S/C14H17BO2S/c1-13(2)14(3,4)17-15(16-13)11-5-6-12-10(9-11)7-8-18-12/h5-9H,1-4H3
InChI key:InChIKey=YFTHTJAPODJVSL-UHFFFAOYSA-N
SMILES:CC1(C)OB(OC1(C)C)C=2C=C3C(=CC2)SC=C3
Synonyms:
  • 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[b]thiophene
  • 2-(Benzo[b]thiophen-5-yl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane
  • Benzo[b]thiophene, 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
  • 2-[Benzothiophen-5-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
  • 2-(Benzo[b]thien-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
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