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CS-W001157 4
Total: USD 88.00

3-Fluoro-4-(3-(trifluoromethyl)-1H-pyrazol-1-yl)aniline

  • CAS No. 1006468-65-0

  • Cat. No. CS-0439678
  • Purity≥98%
  • MDL No.None

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

3-Fluoro-4-(3-(trifluoromethyl)-1H-pyrazol-1-yl)aniline|CS-0439678

Structure of 1006468-65-0

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General Information

  • CAS No. 1006468-65-0
  • Cat. No. CS-0439678
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₇F₄N₃
  • Molecular Weight 245.18
  • Synonym(s) 3-Fluoro-4-[3-(trifluoromethyl)-1H-pyrazol-1-yl]aniline
  • SMILES C1=CC(=C(C=C1N)F)N2C=CC(=N2)C(F)(F)F

Synthesis

  • Route1
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      266327-61-1
    • ~%
    • 3-Fluoro-4-(3-(trifluoromethyl)-1H-pyrazol-1-yl)aniline|CS-0439678
      1006468-65-0

    References

    • Genin, Michael J.; Allwine, Debra A.; Anderson, David J.; Barbachyn, Michael R.; Emmert, D. Edward; Garmon, Stuart A.; Graber, David R.; Grega, Kevin C.; Hester, Jackson B.; Hutchinson, Douglas K.; Morris, Joel; Reischer, Robert J.; Ford, Charles W.; Zurenko, Gary E.; Hamel, Judith C.; Schaadt, Ronda D.; Stapert, Douglas; Yagi, Betty H. Journal of Medicinal Chemistry, 2000 , vol. 43, # 5 p. 953 - 970
  • Route2

    References

    • Genin, Michael J.; Allwine, Debra A.; Anderson, David J.; Barbachyn, Michael R.; Emmert, D. Edward; Garmon, Stuart A.; Graber, David R.; Grega, Kevin C.; Hester, Jackson B.; Hutchinson, Douglas K.; Morris, Joel; Reischer, Robert J.; Ford, Charles W.; Zurenko, Gary E.; Hamel, Judith C.; Schaadt, Ronda D.; Stapert, Douglas; Yagi, Betty H. Journal of Medicinal Chemistry, 2000 , vol. 43, # 5 p. 953 - 970

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-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   43.84
  • LogP   2.6124
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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