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CS-W001157 4
Total: USD 88.00

6-Chloro-3-iodo-1H-pyrazolo[3,4-b]pyrazine

  • CAS No. 1935196-58-9

  • Cat. No. CS-0099300
  • Purity≥95%
  • MDL No.MFCD26521481

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

6-Chloro-3-iodo-1H-pyrazolo[3,4-b]pyrazine|CS-0099300

Structure of 1935196-58-9

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General Information

  • CAS No. 1935196-58-9
  • Cat. No. CS-0099300
  • Purity ≥95%
  • MDL No. MFCD26521481
  • Storage 4°C, sealed storage, away from moisture and light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₂ClIN₄
  • Molecular Weight 280.45
  • Synonym(s) None
  • SMILES IC1=NNC2=NC(Cl)=CN=C21

Description

6-Chloro-3-iodo-1H-pyrazolo[3,4-b]pyrazine is a halogenated heterocyclic scaffold featuring complementary reactivity at the 3- and 6-positions. This electron-deficient core enables efficient cross-coupling transformations, serving as a key building block in medicinal chemistry and materials science. The molecule exhibits bench-stable handling characteristics and compatibility with palladium-catalyzed reactions under standard conditions.

Application

6-Chloro-3-iodo-1H-pyrazolo[3,4-b]pyrazine serves as a versatile bifunctional building block for the synthesis of complex heterocyclic scaffolds. The chloro group enables palladium-catalyzed cross-coupling reactions, while the iodide supports efficient Suzuki-Miyaura and Stille couplings. Its stability under standard reaction conditions and compatibility with diverse functional groups make it ideal for modular assembly of pharmaceutical intermediates and advanced materials.

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-P405-P501

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Computational Chemistry Data

  • TPSA   54.46
  • LogP   1.6109
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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