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CS-W001157 4
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1,3-Bis(benzo[d][1,3]dioxol-5-yl)prop-2-en-1-one

  • CAS No. 76530-89-7

  • Cat. No. CS-0358026
  • Purity≥98%
  • MDL No.None

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

1,3-Bis(benzo[d][1,3]dioxol-5-yl)prop-2-en-1-one|CS-0358026

Structure of 76530-89-7

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General Information

  • CAS No. 76530-89-7
  • Cat. No. CS-0358026
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₁₂O₅
  • Molecular Weight 296.27
  • Synonym(s) Bis(3,4-methylenedioxy)chalcone
  • SMILES O=C(C1=CC=C(OCO2)C2=C1)C=CC3=CC=C(OCO4)C4=C3

Synthesis

  • Route1
    • null|null
      120-57-0
    • 1-(Benzo[d][1,3]dioxol-5-yl)ethanone Paroxetine Impurity|CS-0213986
      3162-29-6
    • ~92%
    • 1,3-Bis(benzo[d][1,3]dioxol-5-yl)prop-2-en-1-one|CS-0358026
      76530-89-7

    References

    • Wattanasin, Sompong; Murphy, William S. Synthesis, 1980 , # 8 p. 647 - 650
  • Route2
    • null|null
      120-57-0
    • 1-(Benzo[d][1,3]dioxol-5-yl)ethanone Paroxetine Impurity|CS-0213986
      3162-29-6
    • ~19%
    • null|null
      1240093-64-4
    • 1,3-Bis(benzo[d][1,3]dioxol-5-yl)prop-2-en-1-one|CS-0358026
      76530-89-7

    References

    • Tetrahedron Letters, , vol. 51, # 32 p. 4237 - 4239

Safety Information

Download SDS
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   53.99
  • LogP   3.0401
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   3

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