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CS-W001157 4
Total: USD 88.00

Methyl 4-(trifluoromethoxy)benzoate

  • CAS No. 780-31-4

  • Cat. No. CS-0188989
  • Purity≥98%
  • MDL No.None

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

Methyl 4-(trifluoromethoxy)benzoate|CS-0188989

Structure of 780-31-4

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General Information

  • CAS No. 780-31-4
  • Cat. No. CS-0188989
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇F₃O₃
  • Molecular Weight 220.15
  • Synonym(s) 2-chloro-1-fluoro-4-(trifluoromethyl)benzene
  • SMILES COC(=O)C1=CC=C(C=C1)OC(F)(F)F

Synthesis

  • Route1
    • null|null
      67-56-1
    • (4-(Trifluoromethoxy)phenyl)methanol|CS-W010710
      1736-74-9
    • ~86%
    • In-stock
      Methyl 4-(trifluoromethoxy)benzoate|CS-0188989
      780-31-4

    References

    • Jagadeesh, Rajenahally V.; Junge, Henrik; Pohl, Marga-Martina; Radnik, Joerg; Brueckner, Angelika; Beller, Matthias Journal of the American Chemical Society, 2013 , vol. 135, # 29 p. 10776 - 10782

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   35.53
  • LogP   2.3718
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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