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CS-W001157 4
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5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoindolin-1-one

  • CAS No. 376584-62-2

  • Cat. No. CS-W003932
  • Purity≥96%
  • MDL No.MFCD11040393

*For research and further manufacturing use only, not for direct human use.

5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoindolin-1-one|CS-W003932

Structure of 376584-62-2

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General Information

  • CAS No. 376584-62-2
  • Cat. No. CS-W003932
  • Purity ≥96%
  • MDL No. MFCD11040393
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₈BNO₃
  • Molecular Weight 259.11
  • Synonym(s) 5-(tetraMethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydro-1H-isoindol-1-one
  • SMILES O=C1NCc2c1ccc(c2)B1OC(C(O1)(C)C)(C)C

Description

This boronate-containing isoindolinone integrates readily into Suzuki-Miyaura coupling reactions under standard conditions, offering high functional group tolerance and stability. The tetramethyl-1,3,2-dioxaborolane moiety enables efficient cross-coupling while maintaining bench-stability and moisture resistance.

Application

5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoindolin-1-one serves as a versatile boronate building block for palladium-catalyzed cross-coupling reactions. Its isoindolin-1-one core provides a rigid, electron-deficient scaffold suitable for medicinal chemistry applications. The stable, bench-friendly boronate group enables efficient coupling with aryl and heteroaryl halides under mild conditions, offering high functional group tolerance and straightforward purification.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   47.56
  • LogP   1.2292
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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