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Methyl 2-chloroquinoline-5-carboxylate

  • CAS No. 1192569-38-2

  • Cat. No. CS-0134132
  • Purity≥98%
  • MDL No.MFCD14706029

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

Methyl 2-chloroquinoline-5-carboxylate|CS-0134132

Structure of 1192569-38-2

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General Information

  • CAS No. 1192569-38-2
  • Cat. No. CS-0134132
  • Purity ≥98%
  • MDL No. MFCD14706029
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₈ClNO₂
  • Molecular Weight 221.64
  • Synonym(s) 2-Chloro-5-quinolinecarboxylic acid methyl ester
  • SMILES O=C(C1=C2C=CC(Cl)=NC2=CC=C1)OC

Synthesis

  • Route1
    • Methyl 2-oxo-1,2-dihydroquinoline-5-carboxylate|CS-0006424
      70758-34-8
    • ~%
    • Methyl 2-chloroquinoline-5-carboxylate|CS-0134132
      1192569-38-2

    References

    • JANSSEN PHARMACEUTICA NV Patent: WO2009/132000 A1, 2009 ; Location in patent: Page/Page column 22 ;
  • Route2
    • null|null
      70758-29-1
    • ~%
    • Methyl 2-chloroquinoline-5-carboxylate|CS-0134132
      1192569-38-2

    References

    • IRM LLC; TULLY, David C.; RUCKER, Paul Vincent; ALPER, Phillip B.; MUTNICK, Daniel; CHIANELLI, Donatella Patent: WO2012/87519 A1, 2012 ; Location in patent: Page/Page column 118 ; WO 2012/087519 A1
  • Route3

    References

    • IRM LLC; TULLY, David C.; RUCKER, Paul Vincent; ALPER, Phillip B.; MUTNICK, Daniel; CHIANELLI, Donatella Patent: WO2012/87519 A1, 2012 ; WO 2012/087519 A1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P362-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   39.19
  • LogP   2.6748
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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