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CS-W001157 4
Total: USD 88.00

(2-Fluoro-4-nitrophenyl)acetic acid

  • CAS No. 315228-19-4

  • Cat. No. CS-W003750
  • Purity≥96%
  • MDL No.MFCD11041422

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

(2-Fluoro-4-nitrophenyl)acetic acid|CS-W003750

Structure of 315228-19-4

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General Information

  • CAS No. 315228-19-4
  • Cat. No. CS-W003750
  • Purity ≥96%
  • MDL No. MFCD11041422
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆FNO₄
  • Molecular Weight 199.14
  • Synonym(s) 2-Fluoro-4-nitrophenylacetic acid
  • SMILES O=C(O)CC1=CC=C([N+]([O-])=O)C=C1F

Description

(2-Fluoro-4-nitrophenyl)acetic acid features a fluorinated aryl ring paired with a nitro group at the para position, enhancing electrophilicity for nucleophilic substitution. The acetic acid side chain provides a handle for conjugation and derivatization. This compound serves as a key intermediate in the synthesis of bioactive molecules and functional materials, particularly where electron-deficient aromatic systems are required.

Application

(2-Fluoro-4-nitrophenyl)acetic acid serves as a versatile building block in synthetic organic chemistry, enabling efficient construction of fluorinated heterocycles and bioactive scaffolds. Its ortho-fluoro and para-nitro substituents provide complementary reactivity for nucleophilic aromatic substitution and reduction sequences. The carboxylic acid functionality facilitates direct coupling or derivatization, while the molecule exhibits good bench stability and ease of purification, making it well-suited for iterative synthesis workflows in medicinal chemistry and process development.

Synthesis

  • Route1
    • Diethyl 2-(2-fluoro-4-nitrophenyl)malonate|CS-0662481
      318471-58-8
    • ~%
    • In-stock
      (2-Fluoro-4-nitrophenyl)acetic acid|CS-W003750
      315228-19-4

    References

    • US2003/225107 A1, ; Page 45 ;
  • Route2
    • In-stock
      2,4-Difluoro-1-nitrobenzene|CS-W020034
      446-35-5
    • null|null
      105-53-3
    • ~%
    • In-stock
      (2-Fluoro-4-nitrophenyl)acetic acid|CS-W003750
      315228-19-4

    References

    • US2003/139390 A1, ; US 20030139390 A1
  • Route3

    References

    • WO2013/29338 A1, ; WO 2013/029338 A1

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   80.44
  • LogP   1.361
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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