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CS-W001157 4
Total: USD 88.00

(E)-But-2-ene-1,4-diyl diacetate

  • CAS No. 1576-98-3

  • Cat. No. CS-0129877
  • Molecule weight172.18
  • Purity≥95%
  • MDL No.MFCD00077968

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

(E)-But-2-ene-1,4-diyl diacetate|CS-0129877

Structure of 1576-98-3

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General Information

  • CAS No. 1576-98-3
  • Cat. No. CS-0129877
  • Purity ≥95%
  • MDL No. MFCD00077968
  • Storage 4°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₂O₄
  • Molecular Weight 172.18
  • Synonym(s) trans-2-Butene-1,4-dioldiacetate
  • SMILES CC(OC/C=C/COC(C)=O)=O

Synthesis

  • Route1

    References

    • Crilley, Martine M. L.; Golding, Bernard T.; Pierpoint, Colin Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1988 , p. 2061 - 2068
  • Route2

    References

    • Occhipinti, Giovanni; Hansen, Fredrik R.; Toernroos, Karl W.; Jensen, Vidar R. Journal of the American Chemical Society, 2013 , vol. 135, # 9 p. 3331 - 3334
  • Route3
    • null|null
      591-87-7
    • ~78%
    • (E)-But-2-ene-1,4-diyl diacetate|CS-0129877
      1576-98-3

    References

    • Michaut, Mathieu; Parrain, Jean-Luc; Santelli, Maurice Chemical Communications, 1998 , # 23 p. 2567 - 2568

Safety Information

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Computational Chemistry Data

  • TPSA   52.6
  • LogP   1.3049
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   4

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