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CS-W001157 4
Total: USD 88.00

Diethyl 3-oxooctanedioate

  • CAS No. 99683-30-4

  • Cat. No. CS-0587117
  • Purity≥98%
  • MDL No.None

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

Diethyl 3-oxooctanedioate|CS-0587117

Structure of 99683-30-4

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General Information

  • CAS No. 99683-30-4
  • Cat. No. CS-0587117
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₂₀O₅
  • Molecular Weight 244.28
  • Synonym(s) Diethyl 2-oxohexane-1,6-dicarboxylate
  • SMILES O=C(CC(CCCCC(OCC)=O)=O)OCC

Synthesis

  • Route1
    • null|null
      64-17-5
    • null|null
      82415-38-1
    • ~71%
    • Diethyl 3-oxooctanedioate|CS-0587117
      99683-30-4

    References

    • Journal of the Chemical Society - Perkin Transactions 1, , # 1 p. 7 - 8
  • Route2

    References

    • Tetrahedron, , vol. 41, # 11 p. 2155 - 2162

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   69.67
  • LogP   1.6322
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   9

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