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CS-W001157 4
Total: USD 88.00

5-Fluoro-2-(trifluoromethoxy)aniline

  • CAS No. 123572-63-4

  • Cat. No. CS-0037440
  • Purity≥97%
  • MDL No.MFCD16652514

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

5-Fluoro-2-(trifluoromethoxy)aniline|CS-0037440

Structure of 123572-63-4

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General Information

  • CAS No. 123572-63-4
  • Cat. No. CS-0037440
  • Purity ≥97%
  • MDL No. MFCD16652514
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅F₄NO
  • Molecular Weight None
  • Synonym(s) 5-Fluoro-2-(trifluoromethoxy)benzenamine
  • SMILES FC1=CC(N)=C(OC(F)(F)F)C=C1

Synthesis

  • Route1
    • null|null
      352-67-0
    • ~%
    • In-stock
      2-Fluoro-5-(trifluoromethoxy)aniline|CS-0084339
      116369-23-4
    • In-stock
      5-Fluoro-2-(trifluoromethoxy)aniline|CS-0037440
      123572-63-4

    References

    • SANOFI-AVENTIS; CHOI-SLEDESKI, Yong-Mi; GARDNER, Charles, J.; LIANG, Guyan; POLI, Gregory, B.; SHUM, Patrick, Wai-Kwok; STOKLOSA, Gregory, T.; ZHAO, Zhicheng Patent: WO2011/22449 A1, 2011 ; Location in patent: Page/Page column 46-47 ; WO 2011/022449 A1
  • Route2

    References

    • VERTEX PHARMACEUTICALS INCORPORATED Patent: WO2004/46120 A2, 2004 ; Location in patent: Page 191 ; WO 2004/046120 A2
  • Route3

    References

    • Clark, Robert D. Journal of Agricultural and Food Chemistry, 1996 , vol. 44, # 11 p. 3643 - 3652

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-H312-H315-H319-H335
Precautionary Statements : P261-P280-P304+P340-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   35.25
  • LogP   2.3065
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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