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CS-W001157 4
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Ethyl 2-(4-methoxy-2-nitrophenyl)acetate

  • CAS No. 108274-39-1

  • Cat. No. CS-0440548
  • Purity≥98%
  • MDL No.None

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

Ethyl 2-(4-methoxy-2-nitrophenyl)acetate|CS-0440548

Structure of 108274-39-1

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General Information

  • CAS No. 108274-39-1
  • Cat. No. CS-0440548
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃NO₅
  • Molecular Weight 239.22
  • Synonym(s) Ethyl (4-Methoxy-2-nitrophenyl)acetate
  • SMILES CCOC(=O)CC1=C(C=C(C=C1)OC)[N+](=O)[O-]

Synthesis

  • Route1
    • null|null
      10565-15-8
    • ~76%
    • Ethyl 2-(4-methoxy-2-nitrophenyl)acetate|CS-0440548
      108274-39-1

    References

    • ZENOBIA THERAPEUTICS, INC.; BOUNAUD, Pierre-Yves; NIENABER, Vicki; STEENSMA, Ruo, W.; LOWE, John, A., III Patent: WO2012/178015 A2, 2012 ; Location in patent: Page/Page column 130 ; WO 2012/178015 A2
  • Route2
    • 1-Chloro-4-methoxy-2-nitrobenzene Iguratimod Impurity|CS-0514516
      10298-80-3
    • ~%
    • Ethyl 2-(4-methoxy-2-nitrophenyl)acetate|CS-0440548
      108274-39-1

    References

    • Quallich; Morrissey Synthesis, 1993 , # 1 p. 51 - 53

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   78.67
  • LogP   1.709
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   5

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