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Chemical Structure| 1007514-99-9 Chemical Structure| 1007514-99-9

Structure of 1007514-99-9

Chemical Structure| 1007514-99-9

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Product Details of [ 1007514-99-9 ]

CAS No. :1007514-99-9
Formula : C9H14N2O2
M.W : 182.22
SMILES Code : O=C(C1=NN(C(C)C)C=C1)OCC
MDL No. :MFCD08700969

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Application In Synthesis of [ 1007514-99-9 ]

* 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 [ 1007514-99-9 ]

[ 1007514-99-9 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 75-30-9 ]
  • [ 5932-27-4 ]
  • [ 1007514-99-9 ]
YieldReaction ConditionsOperation in experiment
96% With sodium ethanolate; In tetrahydrofuran; ethanol; for 16h;Reflux; Step 3: l-Isopropyl-lH-pyrazole-S-carboxylic acid ethyl ester[0165] To lH-<strong>[5932-27-4]pyrazole-3-carboxylic acid ethyl ester</strong> (23.1g, 165 mmol) in THF (330 mL) was added 2-iodopropane (33.OmL, 330 mmol) followed by NaOEt (21percent in EtOH, 65.0 mL, 174 mmol). This solution was then heated to reflux for 16 h. The reaction was then allowed to cool to room temperature. AcOH (10.5 mL, 183 mmol) was added and the reaction was stirred for 5 min. H2O (400 mL) was added to the solution, and this mixture was extracted with EtOAc (3x150 mL). The combined organic was washed with sat. aq. NaHCO3, then brine. The organic was dried over MgSO4, filtered, and concentrated to give the product (28.7Og, 96percent) as a brown oil containing a 98:2 mixture of regioisomers by 1H NMR.
 

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