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CS-W001157 4
Total: USD 88.00

Isoquinolin-3-amine

  • CAS No. 25475-67-6

  • Cat. No. CS-W009009
  • Purity≥98%
  • MDL No.MFCD00102190

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

Isoquinolin-3-amine|CS-W009009

Structure of 25475-67-6

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General Information

  • CAS No. 25475-67-6
  • Cat. No. CS-W009009
  • Purity ≥98%
  • MDL No. MFCD00102190
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₂
  • Molecular Weight 144.17
  • Synonym(s) 3-Aminoisoquinoline
  • SMILES NC1=CC2=CC=CC=C2C=N1

Description

Isoquinolin-3-amine delivers a rigid, electron-rich heteroaromatic scaffold with a strategically positioned primary amine. This functionality enables direct coupling in cross-coupling reactions or integration into pharmaceutical intermediates. The compound exhibits enhanced solubility in polar solvents and stability under standard bench conditions, facilitating straightforward handling in synthetic workflows.

Application

Isoquinolin-3-amine serves as a versatile building block in medicinal chemistry, enabling the construction of bioactive heterocycles through straightforward functionalization at the nitrogen and aromatic positions. Its stability under standard reaction conditions and compatibility with common coupling protocols facilitate efficient synthesis of pharmaceutical scaffolds, including kinase inhibitors and CNS-targeted agents.

Synthesis

  • Route1
    • 2-(2-Formylphenyl)acetonitrile|CS-0328871
      135737-14-3
    • ~68%
    • In-stock
      Isoquinolin-3-amine|CS-W009009
      25475-67-6

    References

    • Zdrojewski; Jonczyk Tetrahedron, 1995 , vol. 51, # 45 p. 12439 - 12444
  • Route2

    References

    • Journal of the American Chemical Society, , vol. 73, p. 688
  • Route3

    References

    • Journal of the American Chemical Society, , vol. 73, p. 688

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   38.91
  • LogP   1.817
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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