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CS-W001157 4
Total: USD 88.00

A-205804

  • CAS No. 251992-66-2

  • Cat. No. CS-0018356
  • Purity≥96%
  • MDL No.MFCD09038566

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

A-205804|CS-0018356

Structure of 251992-66-2

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General Information

  • CAS No. 251992-66-2
  • Cat. No. CS-0018356
  • Purity ≥96%
  • MDL No. MFCD09038566
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₂N₂OS₂
  • Molecular Weight None
  • Synonym(s) None
  • SMILES O=C(C(S1)=CC2=C1C=NC=C2SC3=CC=C(C)C=C3)N

Synthesis

  • Route1
    • null|null
      1336-21-6
    • null|null
      79-37-8
    • null|null
      251992-65-1
    • ~%
    • In-stock
      A-205804|CS-0018356
      251992-66-2

    References

    • Abbott Laboratories Patent: US6232320 B1, 2001 ;
  • Route2
    • 3,5-Dichloropyridine Etoricoxib  Impurity|CS-0229442
      2457-47-8
    • ~%
    • In-stock
      A-205804|CS-0018356
      251992-66-2

    References

    • Stewart; Bhatia; McCarty; Patel; Staeger; Arendsen; Gunawardana; Melcher; Zhu; Boyd; Fry; Cool; Kiflie; Lartey; Marsh; Kempf-Grote; Kilgannon; Wisdom; Meyer; Gallatin; Okasinskit Journal of Medicinal Chemistry, 2001 , vol. 44, # 6 p. 988 - 1002
  • Route3

    References

    • Stewart; Bhatia; McCarty; Patel; Staeger; Arendsen; Gunawardana; Melcher; Zhu; Boyd; Fry; Cool; Kiflie; Lartey; Marsh; Kempf-Grote; Kilgannon; Wisdom; Meyer; Gallatin; Okasinskit Journal of Medicinal Chemistry, 2001 , vol. 44, # 6 p. 988 - 1002

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   55.98
  • LogP   3.85482
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   3

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