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CS-W001157 4
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1,3-Bis(3,4-dimethoxyphenyl)propane-1,3-dione

  • CAS No. 52751-63-0

  • Cat. No. CS-0302226
  • Molecule weight344.36
  • Purity≥98%
  • MDL No.None

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

1,3-Bis(3,4-dimethoxyphenyl)propane-1,3-dione|CS-0302226

Structure of 52751-63-0

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General Information

  • CAS No. 52751-63-0
  • Cat. No. CS-0302226
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₉H₂₀O₆
  • Molecular Weight 344.36
  • Synonym(s) 1,3-Propanedione,1,3-bis(3,4-dimethoxyphenyl)
  • SMILES COC1=C(C=C(C=C1)C(=O)CC(=O)C2=CC(=C(C=C2)OC)OC)OC

Synthesis

  • Route1

    References

    • LUDWIG-MAXIMILIANS-UNIVERSITAeT MUeNCHEN; MAX-PLANCK-GESELLSCHAFT ZUR FOeRDERUNG DER WISSENSCHAFTEN E. V.; GIESE, Armin; BERTSCH, Uwe; KRETZSCHMAR, Hans; HABECK, Mathias; HIRSCHBERGER, Thomas; TAVAN, Paul; GRIESINGER, Christian; LEONOV, Andrei; RYAZANOV, Sergey; WEBER, Petra Patent: WO2010/372 A2, 2010 ; Location in patent: Page/Page column 43-44 ;
  • Route2
    • null|null
      13443-56-6
    • ~6%
    • 3,4-Dimethoxy-2-hydroxyacetophenone|CS-0749742
      37803-48-8
    • 1,3-Bis(3,4-dimethoxyphenyl)propane-1,3-dione|CS-0302226
      52751-63-0

    References

    • Rahimi, Alireza; Azarpira, Ali; Kim, Hoon; Ralph, John; Stahl, Shannon S. Journal of the American Chemical Society, 2013 , vol. 135, # 17 p. 6415 - 6418
  • Route3

    References

    • Choshi; horimoto; Wang; Nagase; Ichikawa; Sugino; Hibino Chemical and Pharmaceutical Bulletin, 1992 , vol. 40, # 4 p. 1047 - 1049

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-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   71.06
  • LogP   3.1767
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   8

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