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CS-W001157 4
Total: USD 88.00

7-Chloroisoquinoline

  • CAS No. 34784-06-0

  • Cat. No. CS-W007219
  • Molecule weight163.61
  • Purity≥98%
  • MDL No.MFCD00094995

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

7-Chloroisoquinoline|CS-W007219

Structure of 34784-06-0

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General Information

  • CAS No. 34784-06-0
  • Cat. No. CS-W007219
  • Purity ≥98%
  • MDL No. MFCD00094995
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₆ClN
  • Molecular Weight 163.61
  • Synonym(s) None
  • SMILES ClC1=CC2=C(C=C1)C=CN=C2

Description

7-Chloroisoquinoline is a bench-stable, electron-deficient heterocycle featuring a chlorine substituent at the 7-position. This configuration enhances its reactivity in transition-metal-catalyzed couplings and facilitates integration into pharmaceutical scaffolds. The para-chloro group serves as a versatile handle for further functionalization.

Application

7-Chloroisoquinoline serves as a versatile building block in medicinal chemistry and catalytic synthesis, enabling direct functionalization at the C-1 and C-3 positions via Pd-catalyzed cross-coupling. Its electron-deficient aromatic core enhances reactivity in nucleophilic substitution and transition-metal-mediated transformations, while maintaining bench stability and ease of purification. Functions as a key scaffold for heterocyclic APIs and advanced intermediates in drug discovery workflows.

Synthesis

  • Route1

    References

    • US2007/254879 A1, ; Page/Page column 29; 30 ;
  • Route2

    References

    • Canadian Journal of Research, Section B: Chemical Sciences, , vol. 27, p. 161,166

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H318-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P362-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   12.89
  • LogP   2.8882
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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