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Ethyl 4,5-dichloro-1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylate

  • CAS No. 853105-72-3

  • Cat. No. CS-0330896
  • Molecule weight250.08
  • Purity95+%
  • MDL No.None

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

Ethyl 4,5-dichloro-1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylate|CS-0330896

Structure of 853105-72-3

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General Information

  • CAS No. 853105-72-3
  • Cat. No. CS-0330896
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉Cl₂NO₃
  • Molecular Weight 250.08
  • Synonym(s) 4,5-DICHLORO-1-METHYL-6-OXO-1,6-DIHYDRO-PYRIDINE-3-CARBOXYLIC ACID ETHYL ESTER
  • SMILES CCOC(=O)C1=CN(C)C(=O)C(=C1Cl)Cl

Synthesis

  • Route1

    References

    • Journal of Medicinal Chemistry, , vol. 49, # 2 p. 441 - 444
  • Route2
    • Ethyl4-hydroxy-1-methyl-6-oxo-pyridine-3-carboxylate|CS-0309935
      853105-37-0
    • ~%
    • Ethyl 4,5-dichloro-1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylate|CS-0330896
      853105-72-3

    References

    • Journal of Medicinal Chemistry, , vol. 49, # 2 p. 441 - 444
  • Route3

    References

    • Journal of Medicinal Chemistry, , vol. 49, # 2 p. 441 - 444

Safety Information

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GHS Pictogram : N/A
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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   48.3
  • LogP   1.8688
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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