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Ethyl 5-oxo-5,6,7,8-tetrahydroquinoline-3-carboxylate

  • CAS No. 106960-78-5

  • Cat. No. CS-0102324
  • Purity≥95%
  • MDL No.MFCD08669650

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

Ethyl 5-oxo-5,6,7,8-tetrahydroquinoline-3-carboxylate|CS-0102324

Structure of 106960-78-5

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General Information

  • CAS No. 106960-78-5
  • Cat. No. CS-0102324
  • Purity ≥95%
  • MDL No. MFCD08669650
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃NO₃
  • Molecular Weight 219.24
  • Synonym(s) 3-Quinolinecarboxylic acid, 5,6,7,8-tetrahydro-5-oxo-, ethyl ester
  • SMILES O=C(C1=CC2=C(N=C1)CCCC2=O)OCC

Synthesis

  • Route1
    • null|null
      861407-17-2
    • In-stock
      3-Amino-2-cyclohexen-1-one|CS-0032855
      5220-49-5
    • ~%
    • In-stock
      Ethyl 5-oxo-5,6,7,8-tetrahydroquinoline-3-carboxylate|CS-0102324
      106960-78-5

    References

    • Torii, Sigeru; Inokuchi, Tsutomu; Kubota, Minoru Synthesis, 1986 , # 5 p. 400 - 402
  • Route2
    • null|null
      80370-42-9
    • ~%
    • In-stock
      Ethyl 5-oxo-5,6,7,8-tetrahydroquinoline-3-carboxylate|CS-0102324
      106960-78-5

    References

    • Torii, Sigeru; Inokuchi, Tsutomu; Kubota, Minoru Synthesis, 1986 , # 5 p. 400 - 402

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   56.26
  • LogP   1.7773
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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