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CS-W001157 4
Total: USD 88.00

Dimethyl 4-oxo-1,4-dihydroquinoline-2,3-dicarboxylate

  • CAS No. 61707-70-8

  • Cat. No. CS-0322810
  • Molecule weight261.23
  • Purity≥98%
  • MDL No.None

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

Dimethyl 4-oxo-1,4-dihydroquinoline-2,3-dicarboxylate|CS-0322810

Structure of 61707-70-8

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General Information

  • CAS No. 61707-70-8
  • Cat. No. CS-0322810
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₁NO₅
  • Molecular Weight 261.23
  • Synonym(s) 2,3-Quinolinedicarboxylic acid, 1,4-dihydro-4-oxo-, dimethyl ester
  • SMILES O=C(C(NC1=C2C=CC=C1)=C(C(OC)=O)C2=O)OC

Synthesis

  • Route1
    • null|null
      201230-82-2
    • null|null
      128942-85-8
    • ~23%
    • Dimethyl 4-oxo-1,4-dihydroquinoline-2,3-dicarboxylate|CS-0322810
      61707-70-8

    References

    • Torii, Sigeru; Okumoto, Hiroshi; He Xu, Long Tetrahedron Letters, 1990 , vol. 31, # 49 p. 7175 - 7178
  • Route2
    • null|null
      251986-52-4
    • ~81%
    • Dimethyl 4-oxo-1,4-dihydroquinoline-2,3-dicarboxylate|CS-0322810
      61707-70-8

    References

    • Mohri, Kunihiko; Kanie, Akihiko; Horiguchi, Yoshie; Isobe, Kimiaki Heterocycles, 1999 , vol. 51, # 10 p. 2377 - 2384
  • Route3
    • null|null
      51175-48-5
    • ~%
    • Dimethyl 4-oxo-1,4-dihydroquinoline-2,3-dicarboxylate|CS-0322810
      61707-70-8

    References

    • Ouali, Mohand Said; Vaultier, Michel; Carrie, Robert Tetrahedron, 1980 , vol. 36, p. 1821 - 1828

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   85.46
  • LogP   1.1013
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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