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CS-W001157 4
Total: USD 88.00

1,3-Diethyl 2-propanoylpropanedioate

  • CAS No. 21633-77-2

  • Cat. No. CS-0260607
  • Purity≥95%
  • MDL No.None

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

1,3-Diethyl 2-propanoylpropanedioate|CS-0260607

Structure of 21633-77-2

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General Information

  • CAS No. 21633-77-2
  • Cat. No. CS-0260607
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₆O₅
  • Molecular Weight 216.23
  • Synonym(s) Diethyl propionylmalonate
  • SMILES O=C(OCC)C(C(CC)=O)C(OCC)=O

Synthesis

  • Route1
    • null|null
      79-03-8
    • null|null
      105-53-3
    • ~86%
    • 1,3-Diethyl 2-propanoylpropanedioate|CS-0260607
      21633-77-2

    References

    • Jung, Jae-Chul; Blake Watkins; Avery, Mitchell A. Heterocycles, 2005 , vol. 65, # 1 p. 77 - 94
  • Route2

    References

    • The Upjohn Company Patent: US5273975 A1, 1993 ;
  • Route3

    References

    • Jung, Jae C.; Watkins, E Blake; Avery, Mitchell A. Synthetic Communications, 2002 , vol. 32, # 24 p. 3767 - 3777

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

Quality Control

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Computational Chemistry Data

  • TPSA   69.67
  • LogP   0.7079
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   6

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