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CS-W001157 4
Total: USD 88.00

5,7-Dihydroxy-3-phenyl-4H-chromen-4-one

  • CAS No. 4044-00-2

  • Cat. No. CS-0320129
  • Purity≥98%
  • MDL No.None

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

5,7-Dihydroxy-3-phenyl-4H-chromen-4-one|CS-0320129

Structure of 4044-00-2

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General Information

  • CAS No. 4044-00-2
  • Cat. No. CS-0320129
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₀O₄
  • Molecular Weight 254.24
  • Synonym(s) 5,7-Dihydroxyisoflavone
  • SMILES C1=CC=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)O)O

Synthesis

  • Route1

    References

    • CHIESI FARMACEUTICI S.p.A. Patent: EP1229036 A1, 2002 ; Location in patent: Page 9 ;
  • Route2
    • 2-Phenyl-1-(2,4,6-trihydroxyphenyl)ethanone|CS-0156336
      727-71-9
    • null|null
      68-12-2
    • ~77%
    • 5,7-Dihydroxy-3-phenyl-4H-chromen-4-one|CS-0320129
      4044-00-2

    References

    • Mrug; Bondarenko; Khilya; Frasinyuk Chemistry of Natural Compounds, 2013 , vol. 49, # 2 p. 235 - 241 Khim. Prir. Soedin., 2013 , # 2 p. 203 - 208,6
  • Route3
    • 2-Phenyl-1-(2,4,6-trihydroxyphenyl)ethanone|CS-0156336
      727-71-9
    • null|null
      122-51-0
    • ~91%
    • 5,7-Dihydroxy-3-phenyl-4H-chromen-4-one|CS-0320129
      4044-00-2

    References

    • Li, Wanmei; Liu, Fangming; Zhang, Pengfei Journal of Chemical Research, 2008 , # 12 p. 683 - 685

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   70.67
  • LogP   2.8712
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   1

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