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CS-W001157 4
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6-Bromo-3-iodo-1-methyl-1H-indazole

  • CAS No. 1260741-78-3

  • Cat. No. CS-0469071
  • Purity≥96%
  • MDL No.MFCD12756577

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

6-Bromo-3-iodo-1-methyl-1H-indazole|CS-0469071

Structure of 1260741-78-3

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General Information

  • CAS No. 1260741-78-3
  • Cat. No. CS-0469071
  • Purity ≥96%
  • MDL No. MFCD12756577
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆BrIN₂
  • Molecular Weight 336.96
  • Synonym(s) None
  • SMILES CN1N=C(I)C2=C1C=C(Br)C=C2

Description

6-Bromo-3-iodo-1-methyl-1H-indazole is a dual-halogenated heterocycle featuring bromine and iodine at the 6- and 3-positions, respectively, with a methyl group on the nitrogen. This configuration enables selective cross-coupling reactions in medicinal chemistry and materials synthesis, where the iodine serves as a superior coupling handle. The molecule exhibits robust stability under standard reaction conditions, facilitating efficient functionalization in complex molecular architectures.

Application

6-Bromo-3-iodo-1-methyl-1H-indazole serves as a versatile dihalogenated building block for palladium-catalyzed cross-coupling reactions. The bromo and iodo substituents enable sequential functionalization at distinct positions, facilitating the construction of complex indazole scaffolds. Its bench-stable nature and compatibility with standard coupling conditions make it ideal for medicinal chemistry campaigns requiring precise heterocyclic diversification.

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
Precautionary Statements : P264-P270-P280-P302+P352-P330-P362+P364-P501

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Computational Chemistry Data

  • TPSA   17.82
  • LogP   2.9404
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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