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CS-W001157 4
Total: USD 88.00

Ethyl 4-(dimethylamino)-2-(methylthio)pyrimidine-5-carboxylate

  • CAS No. 15400-44-9

  • Cat. No. CS-0290461
  • Purity≥97%
  • MDL No.None

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

Ethyl 4-(dimethylamino)-2-(methylthio)pyrimidine-5-carboxylate|CS-0290461

Structure of 15400-44-9

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General Information

  • CAS No. 15400-44-9
  • Cat. No. CS-0290461
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₅N₃O₂S
  • Molecular Weight 241.31
  • Synonym(s) Ethyl 4-(dimethylamino)-2-methylsulfanylpyrimidine-5-carboxylate
  • SMILES O=C(C1=CN=C(SC)N=C1N(C)C)OCC

Synthesis

  • Route1
    • null|null
      13435-20-6
    • null|null
      15400-49-4
    • ~6%
    • Ethyl 4-(dimethylamino)-2-(methylthio)pyrimidine-5-carboxylate|CS-0290461
      15400-44-9
    • null|null
      15400-62-1

    References

    • Hermann, Klaus; Simchen, Gerhard Liebigs Annalen der Chemie, 1981 , # 2 p. 333 - 341
  • Route2
    • Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate Avanafil  Impurity|CS-0228709
      5909-24-0
    • ~%
    • Ethyl 4-(dimethylamino)-2-(methylthio)pyrimidine-5-carboxylate|CS-0290461
      15400-44-9

    References

    • Hermann, Klaus; Simchen, Gerhard Liebigs Annalen der Chemie, 1981 , # 2 p. 333 - 341

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   55.32
  • LogP   1.4412
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   4

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