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CS-W001157 4
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Ethyl 4-(3-methoxy-3-oxopropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate

  • CAS No. 2386-37-0

  • Cat. No. CS-0151851
  • Purity≥95%
  • MDL No.MFCD00030381

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

Ethyl 4-(3-methoxy-3-oxopropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate|CS-0151851

Structure of 2386-37-0

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General Information

  • CAS No. 2386-37-0
  • Cat. No. CS-0151851
  • Purity ≥95%
  • MDL No. MFCD00030381
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₉NO₄
  • Molecular Weight 253.29
  • Synonym(s) ethyl 4-(2-methoxycarbonylethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
  • SMILES CCOC(=O)C1=C(C)C(=C(C)N1)CCC(=O)OC

Synthesis

  • Route1
    • null|null
      122676-34-0
    • ~75%
    • Ethyl 4-(3-methoxy-3-oxopropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate|CS-0151851
      2386-37-0

    References

    • Ganske, Jane A.; Pandey, Ravindra K.; Postich, Michael J.; Snow, Kevin M.; Smith, Kevin M. Journal of Organic Chemistry, 1989 , vol. 54, # 20 p. 4801 - 4807
  • Route2

    References

    • SANOFI PASTEUR SA Patent: US2008/242857 A1, 2008 ; Location in patent: Page/Page column 15 ;
  • Route3

    References

    • Ganske, Jane A.; Pandey, Ravindra K.; Postich, Michael J.; Snow, Kevin M.; Smith, Kevin M. Journal of Organic Chemistry, 1989 , vol. 54, # 20 p. 4801 - 4807

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-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   68.39
  • LogP   1.91384
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   5

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