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CS-W001157 4
Total: USD 88.00

3-Acetamidophenylboronic acid

  • CAS No. 78887-39-5

  • Cat. No. CS-D0989
  • Molecule weight178.98
  • Purity≥98%
  • MDL No.MFCD00236013

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

3-Acetamidophenylboronic acid|CS-D0989

Structure of 78887-39-5

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General Information

  • CAS No. 78887-39-5
  • Cat. No. CS-D0989
  • Purity ≥98%
  • MDL No. MFCD00236013
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₀BNO₃
  • Molecular Weight 178.98
  • Synonym(s) 3-Acetamidobenzeneboronic Acid (contains varying amounts of Anhydride)
  • SMILES OB(C1=CC=CC(NC(C)=O)=C1)O

Application

3-Acetamidophenylboronic acid serves as a reliable building block for Suzuki-Miyaura cross-coupling reactions, enabling efficient construction of biaryl scaffolds in medicinal chemistry and materials science. The acetamido group provides directional control and enhances solubility, while the boronic acid functionality offers excellent stability and compatibility with diverse reaction conditions. Its bench-stable nature facilitates handling and purification, making it a practical choice for iterative synthesis workflows.

Synthesis

  • Route1
    • In-stock
      3-Aminophenylboronic acid|CS-W018320
      30418-59-8
    • null|null
      108-24-7
    • ~96%
    • In-stock
      3-Acetamidophenylboronic acid|CS-D0989
      78887-39-5

    References

    • Radl, Stanislav; Blahovcova, Michaela; Tkadlecova, Marcela; Havlicek, Jaroslav Heterocycles, 2010 , vol. 80, # 2 p. 1359 - 1376
  • Route2

    References

    • Journal of the American Chemical Society, , vol. 53, p. 713
  • Route3
    • null|null
      506-96-7
    • In-stock
      3-Aminophenylboronic acid|CS-W018320
      30418-59-8
    • ~%
    • In-stock
      3-Acetamidophenylboronic acid|CS-D0989
      78887-39-5

    References

    • Journal of the Chemical Society, Perkin Transactions 1, , # 3 p. 407 - 413

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   69.56
  • LogP   -0.6752
  • H_Acceptors   3
  • H_Donors   3
  • Rotatable_Bonds   2

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