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CS-W001157 4
Total: USD 88.00

2-(3-Fluoro-4-iodophenyl)acetic acid

  • CAS No. 1261874-58-1

  • Cat. No. CS-0459765
  • Purity≥95%
  • MDL No.None

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

2-(3-Fluoro-4-iodophenyl)acetic acid|CS-0459765

Structure of 1261874-58-1

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General Information

  • CAS No. 1261874-58-1
  • Cat. No. CS-0459765
  • Purity ≥95%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆FIO₂
  • Molecular Weight 280.03
  • Synonym(s) None
  • SMILES O=C(CC1=CC=C(C(F)=C1)I)O

Description

2-(3-Fluoro-4-iodophenyl)acetic acid features a fluorinated aryl moiety paired with a reactive iodine handle, enabling efficient cross-coupling transformations. The carboxylic acid group provides polarity and synthetic versatility, while the ortho-fluorine enhances electronic modulation. This structure supports direct functionalization in biaryl synthesis and medicinal chemistry applications.

Application

2-(3-Fluoro-4-iodophenyl)acetic acid serves as a versatile building block for palladium-catalyzed cross-coupling reactions, enabling efficient construction of biaryl and heteroaryl scaffolds. The iodine functionality provides high reactivity in Suzuki, Stille, and Negishi couplings, while the carboxylic acid group offers direct handle for derivatization or salt formation. Bench-stable and readily purified by recrystallization, it functions reliably in medicinal chemistry campaigns and API intermediate synthesis.

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

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.0574
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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