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Ethyl 1,6-dimethyl-4-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

  • CAS No. 108958-81-2

  • Cat. No. CS-0329678
  • Purity95+%
  • MDL No.None

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

Ethyl 1,6-dimethyl-4-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate|CS-0329678

Structure of 108958-81-2

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General Information

  • CAS No. 108958-81-2
  • Cat. No. CS-0329678
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₈N₂O₂S
  • Molecular Weight 290.38
  • Synonym(s) Ethyl 1,6-dimethyl-4-phenyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
  • SMILES CCOC(C1=C(N(C(NC1C2=CC=CC=C2)=S)C)C)=O

Synthesis

  • Route1

    References

    • Khanina, E. L.; Mutsenietse, D. Kh.; Kadysh, V. P.; Dubur, G. Ya. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1986 , vol. 22, # 9 p. 990 - 994 Khimiya Geterotsiklicheskikh Soedinenii, 1986 , vol. 22, # 9 p. 1223 - 1227

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302
Precautionary Statements : P264-P270-P330-P501

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Computational Chemistry Data

  • TPSA   41.57
  • LogP   2.3847
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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