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1-Methyl-4-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]-piperazine

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1-Methyl-4-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]-piperazine Basic information

Product Name:
1-Methyl-4-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]-piperazine
Synonyms:
  • 1-Methyl-4-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]-piperazine
  • 1-Methyl-4-(4-nitro-2-(trifluoroMethyl)benzyl)piperazine
  • Piperazine, 1-Methyl-4-[[4-nitro-2-(trifluoroMethyl)phenyl]Methyl]-
  • 4-(4-Methylpiperazin-1-ylMethyl)-3-trifluoroMethyl nitrobenzene
  • Ponatinib Impurity 4
  • 1-(4-nitro-2-(trifluoroMethyl)benzyl)-4-Methylpiperazine
  • PONATINIB INTERMEDIATES NO.4
  • Piperazine, 1-methyl-4-[[4-nitro-2-(trifluoromethyl)phenyl]m...
CAS:
694499-24-6
MF:
C13H16F3N3O2
MW:
303.28
Mol File:
694499-24-6.mol
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1-Methyl-4-[[4-nitro-2-(trifluoromethyl)phenyl]methyl]-piperazine Chemical Properties

Boiling point:
343.5±37.0 °C(Predicted)
Density 
1.305±0.06 g/cm3 (20 ºC 760 Torr)
pka
7.46±0.10(Predicted)
InChI
InChI=1S/C13H16F3N3O2/c1-17-4-6-18(7-5-17)9-10-2-3-11(19(20)21)8-12(10)13(14,15)16/h2-3,8H,4-7,9H2,1H3
InChIKey
LIHFIIDGPWSVCX-UHFFFAOYSA-N
SMILES
N1(C)CCN(CC2=CC=C([N+]([O-])=O)C=C2C(F)(F)F)CC1

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