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CS-W001157 4
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7-Bromo-6-chloroisoquinoline

  • CAS No. 1307316-83-1

  • Cat. No. CS-0038424
  • Molecule weight242.50
  • Purity≥98%
  • MDL No.None

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

7-Bromo-6-chloroisoquinoline|CS-0038424

Structure of 1307316-83-1

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General Information

  • CAS No. 1307316-83-1
  • Cat. No. CS-0038424
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₅BrClN
  • Molecular Weight 242.50
  • Synonym(s) None
  • SMILES C1=CN=CC2=CC(=C(C=C12)Cl)Br

Description

7-Bromo-6-chloroisoquinoline is a halogenated isoquinoline scaffold featuring complementary reactive sites for cross-coupling and functionalization. The electron-deficient ring system enhances electrophilicity at the 7-position, while the ortho-halogen arrangement enables selective palladium-catalyzed transformations. This compound serves as a key building block in medicinal chemistry and materials science.

Application

7-Bromo-6-chloroisoquinoline serves as a versatile building block for the synthesis of complex heterocyclic scaffolds, enabling palladium-catalyzed cross-coupling reactions due to its complementary halogen reactivity. The strategic placement of bromo and chloro groups allows for sequential functionalization, facilitating access to substituted isoquinolines with tailored electronic and steric profiles. Its bench-stable solid form and compatibility with standard coupling conditions make it ideal for medicinal chemistry and process 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   12.89
  • LogP   3.6507
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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