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CS-W001157 4
Total: USD 88.00

3-Iodo-1H-pyrazolo[3,4-c]pyridine

  • CAS No. 1082040-63-8

  • Cat. No. CS-W003796
  • Purity≥98%
  • MDL No.MFCD11845480

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

3-Iodo-1H-pyrazolo[3,4-c]pyridine|CS-W003796

Structure of 1082040-63-8

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General Information

  • CAS No. 1082040-63-8
  • Cat. No. CS-W003796
  • Purity ≥98%
  • MDL No. MFCD11845480
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₄IN₃
  • Molecular Weight 245.02
  • Synonym(s) None
  • SMILES Ic1n[nH]c2c1ccnc2

Description

3-Iodo-1H-pyrazolo[3,4-c]pyridine features a fused heterocyclic core with a strategically positioned iodine atom enabling direct functionalization in cross-coupling reactions. This electron-deficient scaffold integrates readily into complex molecular architectures, offering high reactivity under standard conditions.

Application

3-Iodo-1H-pyrazolo[3,4-c]pyridine serves as a versatile building block for constructing bioactive heterocycles, enabling palladium-catalyzed cross-coupling reactions with broad functional group tolerance. Its iodine moiety facilitates efficient C–C and C–heteroatom bond formation, making it valuable in medicinal chemistry and materials science applications. The scaffold exhibits bench stability and compatibility with standard synthetic workflows.

Synthesis

  • Route1

    References

    • NOVARTIS AG; ALTMANN, Eva; HOMMEL, Ulrich; LORTHIOIS, Edwige Liliane Jeanne; MAIBAUM, Juergen Klaus; OSTERMANN, Nils; QUANCARD, Jean; RANDL, Stefan Andreas; VULPETTI, Anna Patent: WO2014/2051 A2, 2014 ; Location in patent: Page/Page column 54 ;

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   41.57
  • LogP   1.5625
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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