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CS-W001157 4
Total: USD 88.00

2-(2-Fluoro-3,4-dimethoxyphenyl)acetic acid

  • CAS No. 78495-65-5

  • Cat. No. CS-0150634
  • Purity≥97%
  • MDL No.MFCD03411454

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

2-(2-Fluoro-3,4-dimethoxyphenyl)acetic acid|CS-0150634

Structure of 78495-65-5

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General Information

  • CAS No. 78495-65-5
  • Cat. No. CS-0150634
  • Purity ≥97%
  • MDL No. MFCD03411454
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁FO₄
  • Molecular Weight 214.19
  • Synonym(s) 4-Fluoro-3-MethoxyphenylaceticAci
  • SMILES COC1=C(C(=C(C=C1)CC(=O)O)F)OC

Synthesis

  • Route1
    • 2-Fluoro-3,4-dimethoxybenzonitrile|CS-0672005
      78495-64-4
    • ~78%
    • 2-(2-Fluoro-3,4-dimethoxyphenyl)acetic acid|CS-0150634
      78495-65-5

    References

    • Weinstock, Joseph; Gaitanopoulos, Dimitri E.; Oh, Hye-Ja; Pfeiffer, Francis R.; Karash, Carole B.; et al. Journal of Medicinal Chemistry, 1986 , vol. 29, # 9 p. 1615 - 1627
  • Route2
    • 2-Fluoro-3,4-dimethoxybenzeneacetonitrile|CS-0652045
      7537-08-8
    • ~%
    • 2-(2-Fluoro-3,4-dimethoxyphenyl)acetic acid|CS-0150634
      78495-65-5

    References

    • Ross, Stephen T.; Franz, Robert G.; Gallagher, Gregory; Brenner, Martin; Wilson, James W.; et al. Journal of Medicinal Chemistry, 1987 , vol. 30, # 1 p. 35 - 40

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   55.76
  • LogP   1.47
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   4

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