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Chemical Structure| 59824-23-6 Chemical Structure| 59824-23-6

Structure of 59824-23-6

Chemical Structure| 59824-23-6

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Product Details of [ 59824-23-6 ]

CAS No. :59824-23-6
Formula : C15H11NO
M.W : 221.25
SMILES Code : O=C(C1=CC=CC=C1)CC2=CC=C(C#N)C=C2
MDL No. :MFCD02260692

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* 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 [ 59824-23-6 ]

[ 59824-23-6 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 178686-24-3 ]
  • [ 59824-23-6 ]
  • [ 57-13-6 ]
  • [ 1283117-51-0 ]
YieldReaction ConditionsOperation in experiment
11% With hydrogenchloride; In ethanol; water; at 130℃; for 48.0h; 00187] To a solution of 4-(2-oxo-2-phenylethyl)benzonitrile (Intermediate 15) (70 mg, 0.32 mmol), <strong>[178686-24-3]3-ethoxy-4-hydroxy-5-nitrobenzaldehyde</strong> (68 mg, 0.32 mmol), and urea (44 mg, 0.96 mmol) in 20 mL of ethanol was added 0.2 mL of concentrated HCl solution, and the mixture was stirred at 130C for 2 days. After the solvent was removed under reduced pressure, the residue was purified by preparative HPLC (35-75% acetonitrile + 0.1% trifluoroacetic acid in water, over 15 min.) to give the compound 42 (16 mg, yield 11%). 1H NMR (CD3OD 400 MHz): delta 7.64 (s, 1H), 7.41 (d, J = 1.6 Hz, 2H), 7.34-7.31 (m, 5H), 7.25 (s, 1H), 7.06 (d, J = 8.4 Hz, 2H), 5.41 (s, 1H), 4.14-4.09 (m, 2H), 1.43 (t, J = 7.2 Hz, 3H); MS (ESI): m/z 457.2 [M+l]+.
 

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