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CS-W001157 4
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Ethyl 6-oxo-2-phenyl-1,6-dihydro-5-pyrimidinecarboxylate

  • CAS No. 55613-22-4

  • Cat. No. CS-0213093
  • Purity≥98%
  • MDL No.MFCD00695462

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

Ethyl 6-oxo-2-phenyl-1,6-dihydro-5-pyrimidinecarboxylate|CS-0213093

Structure of 55613-22-4

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General Information

  • CAS No. 55613-22-4
  • Cat. No. CS-0213093
  • Purity ≥98%
  • MDL No. MFCD00695462
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₂N₂O₃
  • Molecular Weight 244.25
  • Synonym(s) Ethyl 4-hydroxy-2-phenylpyrimidine-5-carboxylate
  • SMILES CCOC(=O)C1=C(N=C(C2=CC=CC=C2)N=C1)O

Synthesis

  • Route1

    References

    • Journal of the Chemical Society, , vol. 123, p. 2183
  • Route2
    • In-stock
      Ethyl 4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate|CS-B0229
      38026-46-9
    • null|null
      960-16-7
    • ~60%
    • In-stock
      Ethyl 6-oxo-2-phenyl-1,6-dihydro-5-pyrimidinecarboxylate|CS-0213093
      55613-22-4

    References

    • Sun, Qi; Suzenet, Franck; Guillaumet, Gerald Journal of Organic Chemistry, 2010 , vol. 75, # 10 p. 3473 - 3476
  • Route3

    References

    • Chemische Berichte, , vol. 30, p. 1489 Chemische Berichte, , vol. 30, p. 822

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+H312+H332-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   72.31
  • LogP   2.0259
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   3

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