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CS-W001157 4
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3-Chloro-5-iodophenol

  • CAS No. 861347-86-6

  • Cat. No. CS-0038343
  • Molecule weight254.45
  • Purity≥98%
  • MDL No.None

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

3-Chloro-5-iodophenol|CS-0038343

Structure of 861347-86-6

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General Information

  • CAS No. 861347-86-6
  • Cat. No. CS-0038343
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₄ClIO
  • Molecular Weight 254.45
  • Synonym(s) None
  • SMILES C1=C(C=C(C=C1I)O)Cl

Description

3-Chloro-5-iodophenol features a phenolic hydroxyl group flanked by chlorine and iodine substituents, enabling selective coupling reactions in medicinal chemistry. This electron-deficient aryl scaffold supports efficient cross-coupling under standard conditions, delivering complex architectures with high functional group tolerance.

Application

3-Chloro-5-iodophenol serves as a versatile building block for the synthesis of functionalized aromatic scaffolds, enabling palladium-catalyzed cross-coupling reactions due to its complementary halogen reactivity. The ortho-chloro and meta-iodo substituents offer orthogonal handling in sequential coupling protocols, while the phenolic hydroxyl group provides a site for derivatization or metal coordination. Its bench-stable nature and compatibility with standard synthetic workflows make it well-suited for medicinal chemistry and materials development.

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   2.6502
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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