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CS-W001157 4
Total: USD 88.00

Ethyl 3-(trifluoromethoxy)benzoate

  • CAS No. 677713-01-8

  • Cat. No. CS-0539968
  • Purity≥98%
  • MDL No.None

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

Ethyl 3-(trifluoromethoxy)benzoate|CS-0539968

Structure of 677713-01-8

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General Information

  • CAS No. 677713-01-8
  • Cat. No. CS-0539968
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉F₃O₃
  • Molecular Weight 234.17
  • Synonym(s) Benzoic acid, 3-(trifluoromethoxy)-, ethyl ester
  • SMILES CCOC(=O)C1=CC(=CC=C1)OC(F)(F)F

Synthesis

  • Route1
    • null|null
      64-17-5
    • In-stock
      3-(Trifluoromethoxy)benzoic acid|CS-W008406
      1014-81-9
    • ~84%
    • In-stock
      Ethyl 3-(trifluoromethoxy)benzoate|CS-0539968
      677713-01-8

    References

    • SIRTRIS PHARMACEUTICALS, INC.; BLUM, Charles, A.; SPRINGER, Stephanie, K.; VU, Chi, B. Patent: WO2013/59589 A1, 2013 ; Location in patent: Page/Page column 78-79 ;

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   35.53
  • LogP   2.7619
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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