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CS-W001157 4
Total: USD 88.00

3-(3,5-Difluorophenyl)acrylic acid

  • CAS No. 84315-23-1

  • Cat. No. CS-0031469
  • Purity≥98%
  • MDL No.MFCD00010321

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

3-(3,5-Difluorophenyl)acrylic acid|CS-0031469

Structure of 84315-23-1

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General Information

  • CAS No. 84315-23-1
  • Cat. No. CS-0031469
  • Purity ≥98%
  • MDL No. MFCD00010321
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₆F₂O₂
  • Molecular Weight 184.14
  • Synonym(s) 3,5-Difluorocinnamic acid
  • SMILES O=C(/C=C/C1=CC(F)=CC(F)=C1)O

Description

This acrylic acid derivative features a 3,5-difluorophenyl group conjugated to the α,β-unsaturated carbonyl system, delivering enhanced electron-withdrawing character and improved metabolic stability. It serves as a key scaffold in bioactive molecule design, particularly for kinase inhibitors and pharmaceutical intermediates requiring halogenated aromatic functionality.

Application

3-(3,5-Difluorophenyl)acrylic acid serves as a versatile building block in medicinal chemistry, enabling the synthesis of conjugated systems and heterocyclic scaffolds. Its electron-deficient alkene facilitates Diels-Alder reactions and Michael additions, while the carboxylic acid group supports straightforward derivatization via esterification or amidation. Bench-stable and readily purified by recrystallization, it functions reliably in standard synthetic workflows.

Synthesis

  • Route1
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      461-96-1
    • ~%
    • In-stock
      3-(3,5-Difluorophenyl)acrylic acid|CS-0031469
      84315-23-1

    References

    • Journal of Medicinal Chemistry, , vol. 30, # 3 p. 486 - 494
  • Route2

    References

    • Journal of Medicinal Chemistry, , vol. 30, # 3 p. 486 - 494
  • Route3
    • 2-Bromo-4,6-difluoroaniline hydrobromide|CS-0578104
      101471-20-9
    • ~%
    • In-stock
      3-(3,5-Difluorophenyl)acrylic acid|CS-0031469
      84315-23-1

    References

    • Journal of Medicinal Chemistry, , vol. 30, # 3 p. 486 - 494

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P280-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.0626
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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