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CS-W001157 4
Total: USD 88.00

Ethyl 4-chloro-6-fluoroquinoline-3-carboxylate

  • CAS No. 77779-49-8

  • Cat. No. CS-0071054
  • Purity≥97%
  • MDL No.None

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

Ethyl 4-chloro-6-fluoroquinoline-3-carboxylate|CS-0071054

Structure of 77779-49-8

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General Information

  • CAS No. 77779-49-8
  • Cat. No. CS-0071054
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₉ClFNO₂
  • Molecular Weight 253.66
  • Synonym(s) 3-quinolinecarboxylic acid, 4-chloro-6-fluoro-, ethyl ester
  • SMILES O=C(OCC)C1=C(Cl)C2=CC(F)=CC=C2N=C1

Synthesis

  • Route1
    • Ethyl 6-fluoro-4-hydroxyquinoline-3-carboxylate|CS-W010330
      318-35-4
    • ~97%
    • In-stock
      Ethyl 4-chloro-6-fluoroquinoline-3-carboxylate|CS-0071054
      77779-49-8

    References

    • BIOLIPOX AB Patent: WO2007/51982 A1, 2007 ; Location in patent: Page/Page column 43-44 ;
  • Route2
    • null|null
      71083-00-6
    • ~91%
    • In-stock
      Ethyl 4-chloro-6-fluoroquinoline-3-carboxylate|CS-0071054
      77779-49-8

    References

    • JANSSEN PHARMACEUTICA N.V. Patent: WO2004/69792 A2, 2004 ; Location in patent: Page 168 ;
  • Route3
    • null|null
      371-40-4
    • ~%
    • In-stock
      Ethyl 4-chloro-6-fluoroquinoline-3-carboxylate|CS-0071054
      77779-49-8

    References

    • Journal of Medicinal Chemistry, , vol. 49, # 21 p. 6351 - 6363

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H319
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   39.19
  • LogP   3.204
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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