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CS-W001157 4
Total: USD 88.00

3-(N-Boc-amino)phenylboronic acid

  • CAS No. 380430-68-2

  • Cat. No. CS-W000924
  • Purity≥97%
  • MDL No.MFCD03411945

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

3-(N-Boc-amino)phenylboronic acid|CS-W000924

Structure of 380430-68-2

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General Information

  • CAS No. 380430-68-2
  • Cat. No. CS-W000924
  • Purity ≥97%
  • MDL No. MFCD03411945
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₆BNO₄
  • Molecular Weight 237.06
  • Synonym(s) None
  • SMILES O=C(NC1=CC(B(O)O)=CC=C1)OC(C)(C)C

Application

3-(N-Boc-amino)phenylboronic acid serves as a versatile building block for Suzuki-Miyaura cross-coupling reactions, enabling efficient construction of biaryl scaffolds in medicinal chemistry and materials science. The Boc-protected amine group ensures excellent bench stability and compatibility with diverse reaction conditions, while the boronic acid functionality facilitates reliable coupling with aryl halides and triflates. Its orthogonal reactivity profile allows selective functionalization in complex molecule synthesis, making it a practical choice for intermediate preparation in API development workflows.

Synthesis

  • Route1

    References

    • Mao; Hajduk; Craig; Bell; Borre; Fesik Journal of the American Chemical Society, 2001 , vol. 123, # 43 p. 10429 - 10435
  • Route2

    References

    • Thrash, Thomas; Cabell, Larry A.; Lohse, Daniel; Budde, Raymond J.A. Patent: US2006/4002 A1, 2006 ; Location in patent: Page/Page column 40 ;

Safety Information

Download SDS
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   78.79
  • LogP   0.7134
  • H_Acceptors   4
  • H_Donors   3
  • Rotatable_Bonds   2

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