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CS-W001157 4
Total: USD 88.00

Diethyl 2,5-dioxobicyclo[2.2.2]octane-1,4-dicarboxylate

  • CAS No. 843-59-4

  • Cat. No. CS-0151645
  • Purity≥98%
  • MDL No.MFCD00213759

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

Diethyl 2,5-dioxobicyclo[2.2.2]octane-1,4-dicarboxylate|CS-0151645

Structure of 843-59-4

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General Information

  • CAS No. 843-59-4
  • Cat. No. CS-0151645
  • Purity ≥98%
  • MDL No. MFCD00213759
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₈O₆
  • Molecular Weight 282.29
  • Synonym(s) IETHYL 2,5-DIOXOBICYCLO[2.2.2]OCTANE-1,4-DICARBOXYLATE
  • SMILES CCOC(=O)C12CCC(CC1=O)(C(=O)C2)C(=O)OCC

Synthesis

  • Route1
    • Diethyl 2,5-dioxocyclohexane-1,4-dicarboxylate|CS-0672046
      787-07-5
    • null|null
      106-93-4
    • ~81%
    • In-stock
      Diethyl 2,5-dioxobicyclo[2.2.2]octane-1,4-dicarboxylate|CS-0151645
      843-59-4

    References

    • Al Hussainy, Rana; Verbeek, Joost; Van Der Born, Dion; Braker, Anton H.; Leysen, Josee E.; Knol, Remco J.; Booij, Jan; Herscheid Journal of Medicinal Chemistry, 2011 , vol. 54, # 10 p. 3480 - 3491
  • Route2
    • null|null
      106-93-4
    • ~84%
    • In-stock
      Diethyl 2,5-dioxobicyclo[2.2.2]octane-1,4-dicarboxylate|CS-0151645
      843-59-4

    References

    • Lemouchi, Cyprien; Vogelsberg, Cortnie S.; Zorina, Leokadiya; Simonov, Sergey; Batail, Patrick; Brown, Stuart; Garcia-Garibay, Miguel A. Journal of the American Chemical Society, 2011 , vol. 133, # 16 p. 6371 - 6379
  • Route3
    • null|null
      105-53-3
    • ~%
    • In-stock
      Diethyl 2,5-dioxobicyclo[2.2.2]octane-1,4-dicarboxylate|CS-0151645
      843-59-4

    References

    • Journal of the American Chemical Society, , vol. 133, # 10 p. 3570 - 3581

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-H332-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   86.74
  • LogP   0.8112
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   4

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