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CS-W001157 4
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2-Thioxo-2,3-dihydrothieno[2,3-d]pyrimidin-4(1H)-one

  • CAS No. 117516-97-9

  • Cat. No. CS-0075865
  • Molecule weight184.24
  • Purity≥97%
  • MDL No.None

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

2-Thioxo-2,3-dihydrothieno[2,3-d]pyrimidin-4(1H)-one|CS-0075865

Structure of 117516-97-9

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General Information

  • CAS No. 117516-97-9
  • Cat. No. CS-0075865
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₄N₂OS₂
  • Molecular Weight 184.24
  • Synonym(s) 2-Thioxo-2,3- dihydrothieno[2,3-d]pyrimidin-4(1H)-one
  • SMILES S=C1NC(C2=C(SC=C2)N1)=O

Synthesis

  • Route1
    • In-stock
      2-Aminothiophene-3-carboxamide|CS-W004718
      14080-51-4
    • null|null
      140-89-6
    • ~%
    • In-stock
      2-Thioxo-2,3-dihydrothieno[2,3-d]pyrimidin-4(1H)-one|CS-0075865
      117516-97-9

    References

    • Amgen Inc. Patent: US2008/32988 A1, 2008 ; Location in patent: Page/Page column 22 ; US 20080032988 A1
  • Route2
    • In-stock
      2-Aminothiophene-3-carboxamide|CS-W004718
      14080-51-4
    • null|null
      2720-67-4
    • ~%
    • In-stock
      2-Thioxo-2,3-dihydrothieno[2,3-d]pyrimidin-4(1H)-one|CS-0075865
      117516-97-9

    References

    • Chen, Jian Jeffrey; Dewdney, Nolan James; Stahl, Christoph Martin Patent: US2003/207900 A1, 2003 ; Location in patent: Page/Page column 18 ; US 20030207900 A1
  • Route3

    References

    • Song, Yang-Heon; Son, Hoon Young Journal of Heterocyclic Chemistry, 2011 , vol. 48, # 3 p. 597 - 603

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   48.65
  • LogP   1.64719
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   0

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