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CS-W001157 4
Total: USD 88.00

Methyl 3-(trifluoromethoxy)benzoate

  • CAS No. 148438-00-0

  • Cat. No. CS-W014257
  • Purity≥98%
  • MDL No.MFCD00041005

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

Methyl 3-(trifluoromethoxy)benzoate|CS-W014257

Structure of 148438-00-0

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General Information

  • CAS No. 148438-00-0
  • Cat. No. CS-W014257
  • Purity ≥98%
  • MDL No. MFCD00041005
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇F₃O₃
  • Molecular Weight 220.15
  • Synonym(s) Benzoic acid, 3-(trifluoromethoxy)-, methyl ester
  • SMILES COC(=O)C1=CC(OC(F)(F)F)=CC=C1

Synthesis

  • Route1
    • null|null
      143582-88-1
    • ~74%
    • In-stock
      Methyl 3-(trifluoromethoxy)benzoate|CS-W014257
      148438-00-0

    References

    • Kanie, Kiyoshi; Tanaka, Yoichiro; Suzuki, Kazundo; Kuroboshi, Manabu; Hiyama, Tamejiro Bulletin of the Chemical Society of Japan, 2000 , vol. 73, # 2 p. 471 - 484
  • Route2
    • null|null
      143583-01-1
    • ~52%
    • In-stock
      Methyl 3-(trifluoromethoxy)benzoate|CS-W014257
      148438-00-0

    References

    • Kuroboshi, Manabu; Suzuki, Kazundo; Hiyama, Tamejiro Tetrahedron Letters, 1992 , vol. 33, # 29 p. 4173 - 4176
  • Route3

    References

    • Bulletin of the Chemical Society of Japan, , vol. 73, # 2 p. 471 - 484

Safety Information

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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   2.3718
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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