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CS-W001157 4
Total: USD 88.00

5-Ethynyl-2-(methylthio)pyrimidine

  • CAS No. 87573-81-7

  • Cat. No. CS-0609520
  • Molecule weight150.20
  • Purity≥98%
  • MDL No.None

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

5-Ethynyl-2-(methylthio)pyrimidine|CS-0609520

Structure of 87573-81-7

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General Information

  • CAS No. 87573-81-7
  • Cat. No. CS-0609520
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆N₂S
  • Molecular Weight 150.20
  • Synonym(s) Pyrimidine, 5-ethynyl-2-(methylthio)- (9CI)
  • SMILES CSC1=NC=C(C#C)C=N1

Synthesis

  • Route1
    • null|null
      87573-79-3
    • ~8%
    • 5-Ethynyl-2-(methylthio)pyrimidine|CS-0609520
      87573-81-7

    References

    • Benneche, Tore; Undheim, Kjell Acta Chemica Scandinavica, Series B: Organic Chemistry and Biochemistry, 1983 , vol. 37, # 3 p. 235 - 240
  • Route2
    • 1-(2-(Methylthio)pyrimidin-5-yl)ethan-1-one|CS-0971340
      84755-29-3
    • ~%
    • 5-Ethynyl-2-(methylthio)pyrimidine|CS-0609520
      87573-81-7

    References

    • Benneche, Tore; Undheim, Kjell Acta Chemica Scandinavica, Series B: Organic Chemistry and Biochemistry, 1983 , vol. 37, # 3 p. 235 - 240

Safety Information

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

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Computational Chemistry Data

  • TPSA   25.78
  • LogP   1.1798
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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