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CS-W001157 4
Total: USD 88.00

6-Hydroxy-2H-1,3-benzodioxole-5-carbaldehyde

  • CAS No. 4720-68-7

  • Cat. No. CS-0072177
  • Purity≥98%
  • MDL No.None

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

6-Hydroxy-2H-1,3-benzodioxole-5-carbaldehyde|CS-0072177

Structure of 4720-68-7

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General Information

  • CAS No. 4720-68-7
  • Cat. No. CS-0072177
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆O₄
  • Molecular Weight 166.13
  • Synonym(s) 6-hydroxy-1,3-benzodioxole-5-carbaldehyde
  • SMILES O=CC1=CC2=C(C=C1O)OCO2

Synthesis

  • Route1
    • Benzo[d][1,3]dioxol-5-yl acetate|CS-0155009
      326-58-9
    • null|null
      4885-02-3
    • ~95%
    • In-stock
      6-Hydroxy-2H-1,3-benzodioxole-5-carbaldehyde|CS-0072177
      4720-68-7

    References

    • Cueva, Juan Pablo; Chemel, Benjamin R.; Juncosa Jr., Jose I.; Lill, Markus A.; Watts, Val J.; Nichols, David E. European Journal of Medicinal Chemistry, 2012 , vol. 48, p. 97 - 107
  • Route2
    • In-stock
      Sesamol|CS-0016841
      533-31-3
    • null|null
      122-51-0
    • ~73%
    • In-stock
      6-Hydroxy-2H-1,3-benzodioxole-5-carbaldehyde|CS-0072177
      4720-68-7

    References

    • Kureha Chemical Industry Co., Ltd. Patent: EP1357118 A1, 2003 ; Location in patent: Page/Page column 18 ;
  • Route3
    • In-stock
      Sesamol|CS-0016841
      533-31-3
    • null|null
      100-97-0
    • ~64%
    • In-stock
      6-Hydroxy-2H-1,3-benzodioxole-5-carbaldehyde|CS-0072177
      4720-68-7

    References

    • Bailly, Fabrice; Queffelec, Clemence; Mbemba, Gladys; Mouscadet, Jean-Francois; Cotelle, Philippe Bioorganic and Medicinal Chemistry Letters, 2005 , vol. 15, # 22 p. 5053 - 5056

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-P362-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   55.76
  • LogP   0.9334
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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