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CS-W001157 4
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3-(2-Oxo-1,2-dihydropyridin-1-yl)propanoic acid

  • CAS No. 68634-48-0

  • Cat. No. CS-0247445
  • Molecule weight167.16
  • Purity≥97%
  • MDL No.None

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

3-(2-Oxo-1,2-dihydropyridin-1-yl)propanoic acid|CS-0247445

Structure of 68634-48-0

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General Information

  • CAS No. 68634-48-0
  • Cat. No. CS-0247445
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉NO₃
  • Molecular Weight 167.16
  • Synonym(s) 3-(2-oxopyridin-1(2H)-yl)propanoic acid
  • SMILES C1=CC(=O)N(C=C1)CCC(=O)O

Synthesis

  • Route1
    • 3-(2-Oxopyridin-1(2h)-yl)propanenitrile|CS-0269446
      25386-51-0
    • ~%
    • 3-(2-Oxo-1,2-dihydropyridin-1-yl)propanoic acid|CS-0247445
      68634-48-0

    References

    • Journal of the American Chemical Society, , vol. 69, p. 1803
  • Route2
    • null|null
      107-94-8
    • ~%
    • 3-(2-Oxo-1,2-dihydropyridin-1-yl)propanoic acid|CS-0247445
      68634-48-0

    References

    • Journal of the American Chemical Society, , vol. 69, p. 1803
  • Route3

    References

    • Kato,Takeshi; Nakamura, Yushin; Morita, Yutaka Chemical and Pharmaceutical Bulletin, 1983 , vol. 31, # 8 p. 2552 - 2563

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H303-H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   59.3
  • LogP   0.323
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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