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CS-W001157 4
Total: USD 88.00

Dimethyl (2-oxo-3-(3-(trifluoromethyl)phenoxy)propyl)phosphonate

  • CAS No. 54094-19-8

  • Cat. No. CS-0169263
  • Purity≥95%
  • MDL No.MFCD09054713

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

Dimethyl (2-oxo-3-(3-(trifluoromethyl)phenoxy)propyl)phosphonate|CS-0169263

Structure of 54094-19-8

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General Information

  • CAS No. 54094-19-8
  • Cat. No. CS-0169263
  • Purity ≥95%
  • MDL No. MFCD09054713
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₄F₃O₅P
  • Molecular Weight 326.21
  • Synonym(s) Dimethyl [2-Oxo-3-[3-(trifluoromethyl)phenoxy]propyl]phosphonate
  • SMILES O=P(OC)(CC(COC1=CC=CC(C(F)(F)F)=C1)=O)OC

Synthesis

  • Route1
    • Methyl 2-(3-(trifluoromethyl)phenoxy)acetate|CS-0569868
      588-26-1
    • null|null
      756-79-6
    • ~64%
    • In-stock
      Dimethyl (2-oxo-3-(3-(trifluoromethyl)phenoxy)propyl)phosphonate|CS-0169263
      54094-19-8

    References

    • Mudduluru, Harikrishna; Hindupur, Rama M.; Dubey, Pramod K.; Madhavaram, Shankar; Tatini, Lakshmikumar; Subbaraju, Gottumukkala V. Letters in Organic Chemistry, 2011 , vol. 8, # 4 p. 234 - 241
  • Route2
    • Ethyl 2-(3-(trifluoromethyl)phenoxy)acetate|CS-0464847
      22897-99-0
    • null|null
      756-79-6
    • ~%
    • In-stock
      Dimethyl (2-oxo-3-(3-(trifluoromethyl)phenoxy)propyl)phosphonate|CS-0169263
      54094-19-8

    References

    • US3953435 A1, ;
  • Route3

    References

    • WO2011/46569 A1, ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS08
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H317-H319-H335-H360
Precautionary Statements : P261-P264-P271-P272-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   61.83
  • LogP   3.1392
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   7

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