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Methyl 5-amino-2-(trifluoromethoxy)benzoate

  • CAS No. 307989-43-1

  • Cat. No. CS-0367060
  • Molecule weight235.16
  • Purity≥96%
  • MDL No.None

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

Methyl 5-amino-2-(trifluoromethoxy)benzoate|CS-0367060

Structure of 307989-43-1

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General Information

  • CAS No. 307989-43-1
  • Cat. No. CS-0367060
  • Purity ≥96%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈F₃NO₃
  • Molecular Weight 235.16
  • Synonym(s) Benzoic acid, 5-amino-2-(trifluoromethoxy)-, methyl ester
  • SMILES O=C(OC)C1=CC(N)=CC=C1OC(F)(F)F

Synthesis

  • Route1
    • Methyl 5-nitro-2-(trifluoromethoxy)benzoate|CS-0450817
      307989-42-0
    • ~%
    • Methyl 5-amino-2-(trifluoromethoxy)benzoate|CS-0367060
      307989-43-1

    References

    • NOVO NORDISK A/S; AGOURON PHARMACEUTICALS, INC. Patent: EP1183229 B1, 2005 ; Location in patent: Page/Page column 180 ;

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-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   61.55
  • LogP   1.954
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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