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CS-W001157 4
Total: USD 88.00

8-Chloroisoquinoline

  • CAS No. 34784-07-1

  • Cat. No. CS-W022565
  • Purity≥98%
  • MDL No.MFCD07644622

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

8-Chloroisoquinoline|CS-W022565

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General Information

  • CAS No. 34784-07-1
  • Cat. No. CS-W022565
  • Purity ≥98%
  • MDL No. MFCD07644622
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₆ClN
  • Molecular Weight 163.60
  • Synonym(s) Isoquinoline, 8-chloro-
  • SMILES ClC1=CC=CC2=C1C=NC=C2

Description

8-Chloroisoquinoline delivers a potent electron-deficient heterocyclic scaffold ideal for transition metal-catalyzed cross-coupling reactions. This bench-stable, moisture-tolerant compound integrates readily into complex molecular architectures, serving as a key building block in medicinal chemistry and materials science applications.

Application

8-Chloroisoquinoline serves as a versatile heterocyclic building block in medicinal chemistry, enabling direct functionalization at C-1 and C-3 positions via Pd-catalyzed cross-coupling. Its chlorine substituent provides a reliable handle for nucleophilic substitution and transition-metal-mediated transformations. The compound exhibits excellent bench stability, facilitates straightforward purification, and functions as a core scaffold in the synthesis of bioactive isoquinoline derivatives.

Synthesis

  • Route1

    References

    • Graulich, Amaury; Scuvee-Moreau, Jacqueline; Seutin, Vincent; Liegeois, Jean-Francois Journal of Medicinal Chemistry, 2005 , vol. 48, # 15 p. 4972 - 4982
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    References

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

    • Journal of Medicinal Chemistry, , vol. 48, # 15 p. 4972 - 4982

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

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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