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8-Chloroisoquinolin-5-amine

  • CAS No. 934554-41-3

  • Cat. No. CS-0045090
  • Molecule weight178.62
  • Purity≥97%
  • MDL No.MFCD17169868

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

8-Chloroisoquinolin-5-amine|CS-0045090

Structure of 934554-41-3

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General Information

  • CAS No. 934554-41-3
  • Cat. No. CS-0045090
  • Purity ≥97%
  • MDL No. MFCD17169868
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇ClN₂
  • Molecular Weight 178.62
  • Synonym(s) None
  • SMILES NC1=CC=C(Cl)C2=C1C=CN=C2

Description

8-Chloroisoquinolin-5-amine features a chlorinated isoquinoline core with a strategically positioned primary amine at the 5-position, enabling direct functionalization in synthetic transformations. This electron-deficient heterocycle serves as a key scaffold for pharmaceutical intermediates and ligand development.

Application

8-Chloroisoquinolin-5-amine serves as a versatile building block for medicinal chemistry and heterocyclic synthesis, enabling efficient access to isoquinoline-based scaffolds. Its ortho-chloro and amine functionalities support sequential functionalization via palladium-catalyzed cross-coupling and electrophilic substitution. The compound exhibits good bench stability and facilitates straightforward purification, making it well-suited for iterative library synthesis and API development workflows.

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   38.91
  • LogP   2.4704
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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