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CS-W001157 4
Total: USD 88.00

4-(4-(Trifluoromethyl)phenoxy)aniline

  • CAS No. 57478-19-0

  • Cat. No. CS-W021992
  • Purity≥98%
  • MDL No.None

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

4-(4-(Trifluoromethyl)phenoxy)aniline|CS-W021992

Structure of 57478-19-0

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General Information

  • CAS No. 57478-19-0
  • Cat. No. CS-W021992
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₀F₃NO
  • Molecular Weight 253.22
  • Synonym(s) 4-[4-(Trifluoromethyl)phenoxy]aniline
  • SMILES NC1=CC=C(OC2=CC=C(C(F)(F)F)C=C2)C=C1

Synthesis

  • Route1
    • 1-Nitro-4-(4-(trifluoromethyl)phenoxy)benzene|CS-0663368
      34859-78-4
    • ~94%
    • In-stock
      4-(4-(Trifluoromethyl)phenoxy)aniline|CS-W021992
      57478-19-0

    References

    • Rodrigues, Tiago; Da Cruz, Filipa P.; Lafuente-Monasterio, Maria J.; Goncalves, Daniel; Ressurreicao, Ana S.; Sitoe, Ana R.; Bronze, Maria R.; Gut, Jiri; Schneider, Gisbert; Mota, Maria M.; Rosenthal, Philip J.; Prudeincio, Miguel; Gamo, Francisco-Javier; Lopes, Francisca; Moreira, Rui Journal of Medicinal Chemistry, 2013 , vol. 56, # 11 p. 4811 - 4815
  • Route2

    References

    • Bayer CropScience S.A. Patent: EP1275301 A1, 2003 ;
  • Route3
    • null|null
      123-30-8
    • null|null
      98-56-6
    • ~81%
    • In-stock
      4-(4-(Trifluoromethyl)phenoxy)aniline|CS-W021992
      57478-19-0

    References

    • Mokhtar; Abd-Elaziz; Gomaa Journal of Fluorine Chemistry, 2010 , vol. 131, # 5 p. 616 - 620

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   35.25
  • LogP   4.0799
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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