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CS-W001157 4
Total: USD 88.00

5-Methoxybenzofuran

  • CAS No. 13391-28-1

  • Cat. No. CS-0056827
  • Purity≥98%
  • MDL No.None

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

5-Methoxybenzofuran|CS-0056827

Structure of 13391-28-1

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General Information

  • CAS No. 13391-28-1
  • Cat. No. CS-0056827
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈O₂
  • Molecular Weight 148.16
  • Synonym(s) 5-17-04-00203 (Beilstein Handbook Reference)
  • SMILES COC1=CC2=C(C=C1)OC=C2

Description

5-Methoxybenzofuran is a bench-stable heterocyclic scaffold featuring an electron-rich benzofuran core with a methoxy group at the 5-position. This substitution enhances solubility and modulates reactivity, enabling direct incorporation into synthetic routes for pharmaceutical intermediates and functional materials. The molecule’s planar structure supports π-stacking interactions in solid-state applications.

Application

5-Methoxybenzofuran serves as a versatile heterocyclic building block in medicinal chemistry and materials science. Its electron-donating methoxy group enhances solubility and modulates reactivity, enabling efficient palladium-catalyzed cross-coupling reactions. The benzofuran core provides structural rigidity and metabolic stability, making it valuable for constructing bioactive scaffolds and functional organic semiconductors.

Synthesis

  • Route1
    • 1-(2,2-Dimethoxyethoxy)-4-methoxybenzene|CS-1163012
      68426-08-4
    • ~%
    • In-stock
      5-Methoxybenzofuran|CS-0056827
      13391-28-1

    References

    • US6235771 B1, ;
  • Route2

    References

    • Barker, Peter; Finke, Paul; Thompson, Kevan Synthetic Communications, 1989 , vol. 19, # 1, 2 p. 257 - 266
  • Route3
    • null|null
      197314-79-7
    • ~92%
    • In-stock
      5-Methoxybenzofuran|CS-0056827
      13391-28-1

    References

    • Black, Michael; Cadogan; McNab, Hamish; MacPherson, Andrew D.; Roddam, V. Peter; Smith, Carol; Swenson, Helen R. Journal of the Chemical Society - Perkin Transactions 1, 1997 , # 17 p. 2483 - 2493

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   22.37
  • LogP   2.4414
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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