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CS-W001157 4
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Ethyl 4-chloroquinoline-6-carboxylate

  • CAS No. 148018-34-2

  • Cat. No. CS-0041720
  • Purity≥98%
  • MDL No.MFCD16250588

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

Ethyl 4-chloroquinoline-6-carboxylate|CS-0041720

Structure of 148018-34-2

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General Information

  • CAS No. 148018-34-2
  • Cat. No. CS-0041720
  • Purity ≥98%
  • MDL No. MFCD16250588
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₀ClNO₂
  • Molecular Weight 235.67
  • Synonym(s) 4-Chloroquinoline-6-carboxylic acid ethyl ester
  • SMILES CCOC(=O)C1=CC2=C(C=C1)N=CC=C2Cl

Description

Ethyl 4-chloroquinoline-6-carboxylate features a quinoline scaffold with strategic chloro and ester functionalities. This electron-deficient heterocycle integrates readily into cross-coupling reactions, serving as a pivotal building block for pharmaceutical intermediates and functional materials under standard conditions.

Application

Ethyl 4-chloroquinoline-6-carboxylate serves as a versatile building block in the synthesis of quinoline-based pharmaceuticals and agrochemicals. Its defined substitution pattern enables direct functionalization at C-4 via palladium-catalyzed cross-coupling, while the ester group supports further derivatization. The molecule exhibits excellent bench stability and facilitates straightforward purification, making it well-suited for iterative synthetic workflows in medicinal chemistry and process development.

Synthesis

  • Route1
    • null|null
      127286-04-8
    • ~69%
    • In-stock
      Ethyl 4-chloroquinoline-6-carboxylate|CS-0041720
      148018-34-2

    References

    • LACKEY, Karen Elizabeth Patent: US2008/234267 A1, 2008 ; Location in patent: Page/Page column 25 ;

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   39.19
  • LogP   3.0649
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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