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CS-W001157 4
Total: USD 88.00

3-Fluoro-4-iodophenol

  • CAS No. 122927-84-8

  • Cat. No. CS-0157045
  • Purity≥96%
  • MDL No.MFCD12407087

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

3-Fluoro-4-iodophenol|CS-0157045

Structure of 122927-84-8

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General Information

  • CAS No. 122927-84-8
  • Cat. No. CS-0157045
  • Purity ≥96%
  • MDL No. MFCD12407087
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₄FIO
  • Molecular Weight 238.00
  • Synonym(s) 3-Floro-4-iodophenol
  • SMILES C1=CC(=C(C=C1O)F)I

Description

3-Fluoro-4-iodophenol features a strategically positioned fluorine atom and iodine substituent on the phenolic ring, enabling selective cross-coupling reactions. This electron-deficient aryl halide integrates efficiently into complex scaffolds under palladium catalysis, offering high functional group tolerance and robust performance in late-stage diversification workflows.

Application

3-Fluoro-4-iodophenol serves as a versatile building block in medicinal chemistry, enabling palladium-catalyzed cross-coupling reactions such as Suzuki and Stille couplings. The ortho-fluoro and iodo substituents provide complementary reactivity for sequential functionalization. Bench-stable and readily purified by crystallization, it functions as a key intermediate in the synthesis of fluorinated heterocycles and bioactive scaffolds.

Safety Information

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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   20.23
  • LogP   2.1359
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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