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CS-W001157 4
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Ethyl 1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylate

  • CAS No. 10561-91-8

  • Cat. No. CS-0586662
  • Molecule weight181.19
  • Purity≥98%
  • MDL No.None

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

Ethyl 1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylate|CS-0586662

Structure of 10561-91-8

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General Information

  • CAS No. 10561-91-8
  • Cat. No. CS-0586662
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₁NO₃
  • Molecular Weight 181.19
  • Synonym(s) Nicotinic acid, 1,6-dihydro-1-methyl-6-oxo-, ethyl ester
  • SMILES CCOC(=O)C1=CN(C(=O)C=C1)C

Synthesis

  • Route1

    References

    • Newkome, George R.; Kohli, Dalip K.; Kawato, Toshio Journal of Organic Chemistry, 1980 , vol. 45, # 22 p. 4508 - 4511
  • Route2
    • null|null
      74-89-5
    • ~%
    • Ethyl 1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylate|CS-0586662
      10561-91-8

    References

    • Ruzicka Helvetica Chimica Acta, 1921 , vol. 4, p. 491
  • Route3

    References

    • Holman; Wiegand Biochemical Journal, 1943 , vol. 43, p. 423,425

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   48.3
  • LogP   0.562
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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