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Chemical Structure| 10199-51-6 Chemical Structure| 10199-51-6

Structure of 10199-51-6

Chemical Structure| 10199-51-6

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Product Details of [ 10199-51-6 ]

CAS No. :10199-51-6
Formula : C13H14N2O2
M.W : 230.26
SMILES Code : O=C(C1=NN(C)C(C2=CC=CC=C2)=C1)OCC
MDL No. :MFCD08060533

Safety of [ 10199-51-6 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501

Application In Synthesis of [ 10199-51-6 ]

* 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 [ 10199-51-6 ]

[ 10199-51-6 ] Synthesis Path-Downstream   1~3

  • 1
  • [ 5932-30-9 ]
  • [ 74-88-4 ]
  • [ 10199-51-6 ]
  • 2
  • [ 5932-30-9 ]
  • [ 74-88-4 ]
  • [ 10250-63-2 ]
  • [ 10199-51-6 ]
YieldReaction ConditionsOperation in experiment
1.8 g; 400 mg To a stirred solution of 20-1 (2.0 g, 9.24 mmol) in DMF (15.0 mL ) was added K2CO3 (2.54 g, 18.4 mmol) and the reaction mixture was stirred at room temperature for 15 minutes. Methyl iodide (855 µL, 13.8 mmol) was added and the reaction mixture was stirred for 4 hours. TLC showed formation of two new spots. The reaction mixture was diluted with ethyl acetate and water. The layers were separated and the organic layer was washed with water, brine, and dried over sodium sulfate. The solution was concentrated and the crude material was purified by column chromatography (silica, 100-200, gradient 0%-30% ethyl acetate/hexane) to afford 20- 2 (400 mg, 1.73 mmol, 19%) and 20-3 (1.8 g, 7.81 mmol, 85%) as colorless oils.1H NMR (20-2, polar fraction) (400 MHz, CDCl3) δ; 7.47-7.39 (m, 5H), 6.84 (s, 1H), 4.42 (q, J = 14.04, 7.0 Hz, 2H), 3.94 (s, 3H), 1.40 (t, J = 7.08 Hz, 3H).1H NMR (20-3, non-polar fraction) (400 MHz, CDCl3) δ; 7.78 (d, J = 7.4 Hz, 2H), 7.39 (t, J = 7.24 Hz, 2H), 7.32-7.29 (m, 1H), 7.11 (s, 1H), 4.36 (q, J = 14.16, 7.08 Hz, 2H), 4.22 (s, 3H), 1.39 (t, J = 7.0 Hz, 3H)
  • 3
  • [ 5932-30-9 ]
  • [ 77-78-1 ]
  • [ 10199-51-6 ]
YieldReaction ConditionsOperation in experiment
93.4% With potassium carbonate; potassium iodide; In acetone; for 4h;Reflux; The starting material (100 mg, 0.46 mmol) was dissolved in 10 mL of acetone.Add potassium carbonate (190 mg, 1.38 mmol) and potassium iodide (8 mg, 0.046 mmol),Dimethyl sulfate (31.5 mg, 0.25 mmol), refluxing for 4 h,After TLC detects the reaction, it is filtered.The filter cake was washed with 10 mL of ethyl acetate and 10 mL of dichloromethane until no fluorescence.The filtrates were combined and concentrated.Column chromatography purification (petroleum ether: ethyl acetate = 4:1)Yellow solid99mg,Yield 93.4%,
93.4% With potassium carbonate; potassium iodide; In acetone; for 4h;Reflux; The starting material <strong>[5932-30-9]ethyl 5-phenyl-1H-pyrazole-3-carboxylate</strong> (100 mg, 0.46 mmol) was dissolved in 10 mL of acetone.Potassium carbonate (190 mg, 1.38 mmol) and potassium iodide (8 mg, 0.046 mmol) were added.Dimethyl sulfate (31.5 mg, 0.25 mmol), refluxing for 4 h,After the TLC detection reaction was completed, the mixture was filtered, and the filter cake was washed with 10 mL of ethyl acetate and 10 mL of dichloromethane to give no fluorescence.The filtrates were combined and concentrated, purified by column chromatography (petroleum ether: 1: ethyl acetate = 4) to give 99mg yellow solid afterYield 93.4%,
 

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