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CS-W001157 4
Total: USD 88.00

4,6-Diacetylresorcinol

  • CAS No. 2161-85-5

  • Cat. No. CS-0155117
  • Purity≥98%
  • MDL No.MFCD00017655

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

4,6-Diacetylresorcinol|CS-0155117

Structure of 2161-85-5

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General Information

  • CAS No. 2161-85-5
  • Cat. No. CS-0155117
  • Purity ≥98%
  • MDL No. MFCD00017655
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀O₄
  • Molecular Weight 194.19
  • Synonym(s) None
  • SMILES O=C(C=1C=C(C(O)=CC1O)C(=O)C)C

Description

1,1-(4,6-Dihydroxy-1,3-phenylene)bisethanone (4,6-diacetylresorcinol, DAR) is a bifunctional carbonyl compound. Its synthesis by acetylating resorcinol in the presence of zinc chloride has been reported. The crystal structure of DAR has been studied.1,1-(4,6-Dihydroxy-1,3-phenylene)bisethanone (4,6-diacetylresorcinol, DAR) may be used in the synthesis of the following:Schiff base ligandshexadentate chalcogenated bisimine ligands1,5-benzodiazepinesketimine of chitosanmannich baseshydrazone ligandsthiosemicarbazone, semicarbazone and thiocarbohydrazone ligandsbinuclear cobalt(II) and copper(II) complexes europium (III) complexes

Synthesis

  • Route1
    • null|null
      108-24-7
    • null|null
      108-46-3
    • ~76%
    • In-stock
      4,6-Diacetylresorcinol|CS-0155117
      2161-85-5

    References

    • Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy, , vol. 64, # 4 p. 1010 - 1024
  • Route2
    • null|null
      64-19-7
    • null|null
      108-46-3
    • ~93%
    • In-stock
      4,6-Diacetylresorcinol|CS-0155117
      2161-85-5

    References

    • WO2004/80939 A1, ; Page 11-12 ;
  • Route3
    • null|null
      108-24-7
    • null|null
      108-46-3
    • ~71%
    • 2,4-Diacetylresorcinol|CS-0652058
      2163-12-4
    • In-stock
      4,6-Diacetylresorcinol|CS-0155117
      2161-85-5

    References

    • European Journal of Medicinal Chemistry, , vol. 47, # 1 p. 97 - 103

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+H312+H332-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   74.6
  • LogP   1.503
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   2

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