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Chemical Structure| 132834-58-3 Chemical Structure| 132834-58-3

Structure of 132834-58-3

Chemical Structure| 132834-58-3

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Product Details of [ 132834-58-3 ]

CAS No. :132834-58-3
Formula : C10H12F3N3
M.W : 231.22
SMILES Code : FC(F)(F)C1=CN=C(C=C1)N1CCNCC1
MDL No. :MFCD00114708
InChI Key :BNMSJUIMZULLAS-UHFFFAOYSA-N
Pubchem ID :667618

Safety of [ 132834-58-3 ]

GHS Pictogram:
Signal Word:Danger
Hazard Statements:H301
Precautionary Statements:P264-P270-P301+P310+P330-P405-P501
Class:6.1
UN#:2811
Packing Group:

Application In Synthesis of [ 132834-58-3 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 132834-58-3 ]

[ 132834-58-3 ] Synthesis Path-Downstream   1~4

  • 1
  • [ 132834-58-3 ]
  • [ 182438-98-8 ]
  • [ 331767-41-0 ]
YieldReaction ConditionsOperation in experiment
EXAMPLE 27 9-{4-[4-(5-trifluoromethyl-pyridin-2-yl)-piperazin-1-yl]-butyl}-9H-fluorene-9-carboxylic acid-(2,2,2-trifluoroethyl)-amide Prepared analogously to Example 2 b from 1-(5-trifluoromethyl-pyridin-2-yl)-piperazine and 9-(4-bromo-butyl)-9H-fluorene-9-carboxylic acid-(2,2,2-trifluoroethyl)-amide. Yield: 0.19 g (33% of theoretical). Melting point: 147-149 C. C30H30F6N4O (M=576.59).
  • 2
  • [ 401564-36-1 ]
  • [ 132834-58-3 ]
  • [ 401566-29-8 ]
  • 3
  • [ 58656-98-7 ]
  • [ 132834-58-3 ]
  • [ 866002-10-0 ]
YieldReaction ConditionsOperation in experiment
18% With potassium carbonate; In dimethylsulfoxide-d6; at 130℃; for 16h; To a solution of 1- (4-trifluoromethyl- pyridin-2-yl)-piperazine (233) (500mg, 2.16 mmol) in DMSO were added 4-fluoro-benzoic acid ter-butyl ester (466 mg, 2.37 mmol) (234) and K2CO3 (1.2 g, 11.3 mmol). The mixture was heated for 16 h at 130C, cooled, filtered and concentrated in vacuo. The residue was purified by flash chromatography (eluent AcOEt-hexane from 40: 60 to pure AcOEt) to afford the title compound 244 (162 mg, 18 % yield). LRMS: (calcd.) 406.4 : (found) 407.4 (MH) +.
  • 4
  • [ 34584-69-5 ]
  • [ 132834-58-3 ]
  • [ 1204977-19-4 ]
YieldReaction ConditionsOperation in experiment
82% With triethylamine; In 1-methyl-pyrrolidin-2-one; at 180℃; for 0.416667h; 1-(5-Trifluoromethyl-pyridin-2-yl)-piperazine (10 g, 43.3 mmol) is combined with <strong>[34584-69-5]3,6-dichloro-4,5-dimethyl-pyridazine</strong> (14.4 g, 84.3 mmol), triethylamine (8.25 mL), and NMP (40 mL). The reaction mixture is heated to a temperature of 180° C. for 25 min, and then concentrated in vacuo. The residue is purified by flash chromatography on silica gel (0-8percent MeOH/CH2Cl2) to afford the title compound (13.2 g, 82percent). 1H NMR (400 MHz, DMSO-d6) delta=8.48-8.41 (m, 1H) 7.84 (dd, J=9.1 Hz, 2.4 Hz, 1H) 7.03 (d, J=9.1 Hz, 1H) 3.88-3.76 (m, 4H) 3.28-3.20 (m, 4H) 2.31 (s, 6H).
 

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