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CS-W001157 4
Total: USD 88.00

Parecoxib sodium impurity 10

  • CAS No. 198471-06-6

  • Cat. No. CS-0096391
  • Molecule weight356.40
  • Purity≥97%
  • MDL No.MFCD26940316

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

Parecoxib sodium impurity 10|CS-0096391

Structure of 198471-06-6

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General Information

  • CAS No. 198471-06-6
  • Cat. No. CS-0096391
  • Purity ≥97%
  • MDL No. MFCD26940316
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₈H₁₆N₂O₄S
  • Molecular Weight 356.40
  • Synonym(s) None
  • SMILES CC(NS(=O)(C1=CC=C(C2=C(C)ON=C2C3=CC=CC=C3)C=C1)=O)=O

Synthesis

  • Route1
    • null|null
      108-24-7
    • In-stock
      Valdecoxib|CS-1674
      181695-72-7
    • ~87%
    • In-stock
      Parecoxib sodium impurity 10|CS-0096391
      198471-06-6

    References

    • Talley, John J.; Bertenshaw, Stephen R.; Brown, David L.; Carter, Jeffery S.; Graneto, Matthew J.; Kellogg, Michael S.; Koboldt, Carol M.; Yuan, Jinhua; Zhang, Yan Y.; Seibert, Karen Journal of Medicinal Chemistry, 2000 , vol. 43, # 9 p. 1661 - 1663

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   89.27
  • LogP   3.14182
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   4

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