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CS-W001157 4
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Dimethyl 5-methoxyisophthalate

  • CAS No. 20319-44-2

  • Cat. No. CS-0196966
  • Purity≥98%
  • MDL No.None

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

Dimethyl 5-methoxyisophthalate|CS-0196966

Structure of 20319-44-2

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General Information

  • CAS No. 20319-44-2
  • Cat. No. CS-0196966
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₂O₅
  • Molecular Weight 224.21
  • Synonym(s) 5-METHOXY-METHYL ISOPHTHALATE
  • SMILES COC1=CC(=CC(=C1)C(=O)OC)C(=O)OC

Synthesis

  • Route1
    • In-stock
      Dimethyl 5-hydroxyisophthalate|CS-W008167
      13036-02-7
    • null|null
      74-88-4
    • ~99%
    • In-stock
      Dimethyl 5-methoxyisophthalate|CS-0196966
      20319-44-2

    References

    • ASTRAZENECA AB; NPS PHARMACEUTICALS, INC. Patent: WO2004/14902 A2, 2004 ; Location in patent: Page 37-38 ; WO 2004/014902 A2
  • Route2
    • In-stock
      5-Hydroxyisophthalic acid|CS-W017132
      618-83-7
    • null|null
      74-88-4
    • ~91%
    • In-stock
      Dimethyl 5-methoxyisophthalate|CS-0196966
      20319-44-2

    References

    • Lienard, Benoit M.R.; Horsfall, Louise E.; Galleni, Moreno; Frere, Jean-Marie; Schofield, Christopher J. Bioorganic and Medicinal Chemistry Letters, 2007 , vol. 17, # 4 p. 964 - 968
  • Route3

    References

    • Journal of the Chemical Society, , p. 418,420

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

Quality Control

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Computational Chemistry Data

  • TPSA   61.83
  • LogP   1.2684
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   3

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