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CS-W001157 4
Total: USD 88.00

Ethyl 2-oxo-1,2-dihydroquinoline-3-carboxylate

  • CAS No. 85870-47-9

  • Cat. No. CS-0049503
  • Purity≥97%
  • MDL No.None

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

Ethyl 2-oxo-1,2-dihydroquinoline-3-carboxylate|CS-0049503

Structure of 85870-47-9

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General Information

  • CAS No. 85870-47-9
  • Cat. No. CS-0049503
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₁NO₃
  • Molecular Weight 217.22
  • Synonym(s) 3-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-, ethyl ester
  • SMILES CCOC(=O)C1=CC2=CC=CC=C2NC1=O

Synthesis

  • Route1
    • 1,3-Diethyl 2-[(2-nitrophenyl)methylidene]propanedioate|CS-0208653
      17422-56-9
    • ~96%
    • In-stock
      Ethyl 2-oxo-1,2-dihydroquinoline-3-carboxylate|CS-0049503
      85870-47-9

    References

    • Stover, James S.; Shi, Jin; Jin, Wei; Vogt, Peter K.; Boger, Dale L. Journal of the American Chemical Society, 2009 , vol. 131, p. 3342 - 3348
  • Route2
    • In-stock
      2-Aminobenzaldehyde|CS-W007486
      529-23-7
    • null|null
      105-53-3
    • ~68%
    • In-stock
      Ethyl 2-oxo-1,2-dihydroquinoline-3-carboxylate|CS-0049503
      85870-47-9

    References

    • Ukrainets, I. V.; Taran, S. G.; Gorokhova, O. V.; Marusenko, N. A.; Kovalenko, S. N.; et al. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1995 , vol. 31, # 2 p. 167 - 175 Khimiya Geterotsiklicheskikh Soedinenii, 1995 , # 2 p. 195 - 203
  • Route3

    References

    • Park, Kwanghee Koh; Jung, Jin Young Heterocycles, 2005 , vol. 65, # 9 p. 2095 - 2105

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   59.16
  • LogP   1.7048
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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