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CS-W001157 4
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5-Bromoisoquinolin-8-amine

  • CAS No. 90721-35-0

  • Cat. No. CS-0037082
  • Purity≥96%
  • MDL No.MFCD09261047

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

5-Bromoisoquinolin-8-amine|CS-0037082

Structure of 90721-35-0

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General Information

  • CAS No. 90721-35-0
  • Cat. No. CS-0037082
  • Purity ≥96%
  • MDL No. MFCD09261047
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇BrN₂
  • Molecular Weight 223.07
  • Synonym(s) 8-isoquinolinamine, 5-bromo-
  • SMILES C1=CC(=C2C=NC=CC2=C1Br)N

Description

5-Bromoisoquinolin-8-amine delivers a brominated isoquinoline scaffold with a strategically positioned amine for downstream functionalization. This electron-deficient heterocycle features high stability and compatibility with palladium-catalyzed cross-coupling reactions. The para-bromine and ortho-amino groups enable selective derivatization, making it ideal for constructing complex pharmaceutical intermediates and advanced materials.

Application

5-Bromoisoquinolin-8-amine serves as a versatile building block for the synthesis of isoquinoline-based scaffolds in medicinal chemistry and materials science. The bromo group enables palladium-catalyzed cross-coupling reactions, while the primary amine facilitates derivatization via amidation or alkylation. Its stability under standard bench conditions and compatibility with diverse reaction environments make it suitable for iterative synthesis workflows.

Synthesis

  • Route1

    References

    • Bioorganic and Medicinal Chemistry, , vol. 12, # 4 p. 715 - 734
  • Route2

    References

    • Bioorganic and Medicinal Chemistry, , vol. 12, # 4 p. 715 - 734

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H319
Precautionary Statements : P264-P270-P280-P330-P405-P501

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Computational Chemistry Data

  • TPSA   38.91
  • LogP   2.5795
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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