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CS-W001157 4
Total: USD 88.00

2-(2,2,2-Trifluoroethoxy)aniline

  • CAS No. 57946-60-8

  • Cat. No. CS-0207338
  • Purity≥98%
  • MDL No.MFCD00077605

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

2-(2,2,2-Trifluoroethoxy)aniline|CS-0207338

Structure of 57946-60-8

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General Information

  • CAS No. 57946-60-8
  • Cat. No. CS-0207338
  • Purity ≥98%
  • MDL No. MFCD00077605
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈F₃NO
  • Molecular Weight 191.15
  • Synonym(s) benzenamine, 2-(2,2,2-trifluoroethoxy)-
  • SMILES C1=CC=C(C(=C1)N)OCC(F)(F)F

Synthesis

  • Route1

    References

    • BIOGEN IDEC MA INC.; CHAO, Jianhua; ENYEDY, Istvan, J.; GUERTIN, Kevin; HUTCHINGS, Richard, H.; JONES, John, Howard; POWELL, Noel; VANVLOTEN, Kurt, D. Patent: WO2014/8214 A1, 2014 ; Location in patent: Paragraph 00500; 00502 ;
  • Route2
    • null|null
      7439-89-6
    • In-stock
      1-Nitro-2-(2,2,2-trifluoroethoxy)benzene|CS-0207303
      87014-28-6
    • ~94%
    • In-stock
      2-(2,2,2-Trifluoroethoxy)aniline|CS-0207338
      57946-60-8

    References

    • KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY Patent: EP966466 B1, 2002 ;
  • Route3
    • null|null
      88-75-5
    • ~%
    • In-stock
      2-(2,2,2-Trifluoroethoxy)aniline|CS-0207338
      57946-60-8

    References

    • Journal of Medicinal Chemistry, , vol. 40, # 17 p. 2674 - 2687

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   35.25
  • LogP   2.2099
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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