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5-Bromo-3-isopropyl-1H-indazole

  • CAS No. 1276075-40-1

  • Cat. No. CS-0187118
  • Molecule weightNone
  • Purity≥97%
  • MDL No.MFCD22034709

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

5-Bromo-3-isopropyl-1H-indazole|CS-0187118

Structure of 1276075-40-1

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General Information

  • CAS No. 1276075-40-1
  • Cat. No. CS-0187118
  • Purity ≥97%
  • MDL No. MFCD22034709
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁BrN₂
  • Molecular Weight None
  • Synonym(s) 5-bromo-3-(propan-2-yl)-1H-indazole
  • SMILES CC(C)C1=NNC2=C1C=C(C=C2)Br

Description

5-Bromo-3-isopropyl-1H-indazole is a bench-stable heterocyclic scaffold featuring a bromo substituent at the 5-position and a sterically hindered isopropyl group at the 3-position. This combination enhances solubility and metabolic stability, enabling efficient coupling in cross-coupling reactions and facilitating incorporation into functionalized pharmaceutical intermediates.

Application

5-Bromo-3-isopropyl-1H-indazole serves as a versatile building block in medicinal chemistry, enabling palladium-catalyzed cross-coupling reactions due to its well-established bromine reactivity. The isopropyl group enhances solubility and modulates electronic properties, while the indazole core provides a stable, bioisosteric scaffold for drug discovery. Bench-stable and amenable to standard purification techniques, it facilitates efficient synthesis of complex heterocyclic architectures.

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-H320-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   28.68
  • LogP   3.4488
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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