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CS-W001157 4
Total: USD 88.00

Ethyl 4-(2-nitrophenyl)-3-oxobutanoate

  • CAS No. 66073-33-4

  • Cat. No. CS-0038009
  • Molecule weight251.24
  • Purity≥97%
  • MDL No.MFCD01926658

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

Ethyl 4-(2-nitrophenyl)-3-oxobutanoate|CS-0038009

Structure of 66073-33-4

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General Information

  • CAS No. 66073-33-4
  • Cat. No. CS-0038009
  • Purity ≥97%
  • MDL No. MFCD01926658
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃NO₅
  • Molecular Weight 251.24
  • Synonym(s) ETHYL 4-(2-NITROPHENYL)ACETOACETATE
  • SMILES CCOC(=O)CC(=O)CC1=C(C=CC=C1)[N+](=O)[O-]

Synthesis

  • Route1
    • null|null
      61417-33-2
    • ~66%
    • In-stock
      Ethyl 4-(2-nitrophenyl)-3-oxobutanoate|CS-0038009
      66073-33-4

    References

    • Palazzino; Cecchi; Colotta; Melani; Filacchioni Journal of Heterocyclic Chemistry, 1989 , vol. 26, # 1 p. 71 - 75
  • Route2

    References

    • Attia, Mohamed I.; Gueclue, Deniz; Hertlein, Barbara; Julius, Justin; Witt-Enderby, Paula A.; Zlotos, Darius P. Organic and Biomolecular Chemistry, 2007 , vol. 5, # 13 p. 2129 - 2137
  • Route3
    • null|null
      64-17-5
    • null|null
      1069111-98-3
    • ~89%
    • In-stock
      Ethyl 4-(2-nitrophenyl)-3-oxobutanoate|CS-0038009
      66073-33-4

    References

    • Royer, Daniel; Wong, Yung-Sing; Ple, Sophie; Chiaroni, Angele; Diker, Khalid; Levy, Jean Tetrahedron, 2008 , vol. 64, # 40 p. 9607 - 9618

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   86.51
  • LogP   1.6596
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   6

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