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Ethyl 5-(2-methoxyphenyl)-1H-pyrazole-3-carboxylate

  • CAS No. 939053-53-9

  • Cat. No. CS-0122778
  • Purity≥98%
  • MDL No.MFCD09749416

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

Ethyl 5-(2-methoxyphenyl)-1H-pyrazole-3-carboxylate|CS-0122778

Structure of 939053-53-9

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General Information

  • CAS No. 939053-53-9
  • Cat. No. CS-0122778
  • Purity ≥98%
  • MDL No. MFCD09749416
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₄N₂O₃
  • Molecular Weight 246.26
  • Synonym(s) Ethyl 3-(2-Methoxyphenyl)-1H-pyrazole-5-carboxylate
  • SMILES O=C(C1=NNC(C2=CC=CC=C2OC)=C1)OCC

Synthesis

  • Route1
    • Ethyl 4-(2-methoxyphenyl)-2,4-dioxobutanoate|CS-0122060
      60943-39-7
    • ~%
    • Ethyl 5-(2-methoxyphenyl)-1H-pyrazole-3-carboxylate|CS-0122778
      939053-53-9

    References

    • Cao, Sheldon X.; Feng, Jun; Imaeda, Yasuhiro; Gwaltney, Stephen L.; Hosfield, David J.; Takakura, Nobuyuki; Tang, Mingnam Patent: US2007/197532 A1, 2007 ; Location in patent: Page/Page column 48 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P362-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   64.21
  • LogP   2.262
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   4

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