ChemicalBook > CAS DataBase List > 4-(4-Methylpiperazinomethyl)-3-(trifluoromethyl)aniline

4-(4-Methylpiperazinomethyl)-3-(trifluoromethyl)aniline

4-(4-Methylpiperazinomethyl)-3-(trifluoromethyl)aniline Structure
4-(4-Methylpiperazinomethyl)-3-(trifluoromethyl)aniline
  • CAS No.694499-26-8
  • Chemical Name:4-(4-Methylpiperazinomethyl)-3-(trifluoromethyl)aniline
  • CBNumber:CB92520701
  • Molecular Formula:C13H18F3N3
  • Formula Weight:273.3
  • MOL File:694499-26-8.mol
4-(4-Methylpiperazinomethyl)-3-(trifluoromethyl)aniline Property
  • Boiling point 329.1±42.0 °C(Predicted)
  • Density 1.227
  • storage temp. under inert gas (nitrogen or Argon) at 2–8 °C
  • pka 7.55±0.10(Predicted)
  • form Solid
  • color Light yellow to yellow
  • InChI InChI=1S/C13H18F3N3/c1-18-4-6-19(7-5-18)9-10-2-3-11(17)8-12(10)13(14,15)16/h2-3,8H,4-7,9,17H2,1H3
  • InChIKey ZMWAZMYBMAAMAW-UHFFFAOYSA-N
  • SMILES C1(N)=CC=C(CN2CCN(C)CC2)C(C(F)(F)F)=C1
  • FDA UNII KFW56NE7FT
Safety
  • HS Code  :2933599590
Hazard and Precautionary Statements (GHS)
  • Symbol(GHS)
  • Signal wordWarning
  • Hazard statements H302+H332-H315-H319-H335
  • Precautionary statements P280

4-(4-Methylpiperazinomethyl)-3-(trifluoromethyl)aniline Chemical Properties,Usage,Production

  • Uses 4-(6-Acryloyloxyhexyloxy)-benzoesure (4-cyanophenylester) can be used as an intermediate in organic synthesis, mainly used in laboratory research and development and in the process of chemical and pharmaceutical synthesis.
  • Synthesis Synthesis_694499-26-8
    4-((4-Methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)aniline Into a solution 4-methyl-1-(4-nitro-2-(trifluoromethyl)benzyl)piperazine (1.5 g, 5 mmol) in MeOH (250 mL) was added Raney Nickel (0.15 g, 10 wt %). The suspension was stirred under hydrogen atmosphere (50 psi) for 24 hrs and monitored by TLC. The reaction mixture was filtered through celite and the filtrate was concentrated under reduced pressure to yield the desired product (1.36 g, 100%). 1H NMR (300 MHz, CDCl3) |?: 7.43-7.46 (1H, d, J=9.0 Hz), 6.91 (1H, s), 6.77-6.80 (1H, d J=9.0 Hz), 3.77 (2H, s), 3.54 (2H, s), 2.53 (8H, brs), 2.34 (3H, s).
  • storage Store long-term at 2-8°C.
4-(4-Methylpiperazinomethyl)-3-(trifluoromethyl)aniline Preparation Products And Raw materials
Raw materials
Preparation Products
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4-(4-Methylpiperazinomethyl)-3-(trifluoromethyl)aniline Spectrum
694499-26-8, 4-(4-Methylpiperazinomethyl)-3-(trifluoromethyl)anilineRelated Search:
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