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Chemical Structure| 68701-47-3 Chemical Structure| 68701-47-3

Structure of 68701-47-3

Chemical Structure| 68701-47-3

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Product Details of [ 68701-47-3 ]

CAS No. :68701-47-3
Formula : C10H11NO2
M.W : 177.20
SMILES Code : NC1=C(C=C(C=C1)C1CC1)C(O)=O
MDL No. :MFCD06802840

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Application In Synthesis of [ 68701-47-3 ]

* 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 [ 68701-47-3 ]

[ 68701-47-3 ] Synthesis Path-Downstream   1~2

  • 1
  • [ 68701-47-3 ]
  • [ 72605-86-8 ]
  • [ 83350-75-8 ]
  • 2
  • [ 38696-20-7 ]
  • [ 68701-47-3 ]
  • [ 1119084-96-6 ]
YieldReaction ConditionsOperation in experiment
57% With copper(I) oxide; copper; potassium carbonate; In 1,2-dimethoxyethane; at 130℃; Example 1; 5-cyclopropyl-2-(2-phenylpyrimidin-5-ylamino)benzoic acidIn a schlenck tube, a mixture of Intermediate 8 (0.2Og, 1.15mmol), Intermediate 21 (0.30, 1.15mmol), potassium carbonate (1.72 mmol, 0.238 g), Cu2O (0.06 mmol, 0.008 g) and Cu (0.11 mmol, 0.007 g) in DME (5 ml) was heated at 13O0C overnight, under argon atmosphere. The solvent was evaporated and the crude mixture was purified over SiO2 <n="77"/>eluting with CH2CI2/ MeOH mixtures affording 0.12O g (57percent of yield) of the expected compound.1H NMR (400 MHz, DMSO-d6) delta ppm 0.6 (s, 2 H) 0.9 (m, 2 H) 1.9 (m, 1 H) 7.2 (d,J=8.6 Hz, 1 H) 7.3 (d, J=8.2 Hz, 1 H) 7.5 (m, 2 H) 7.7 (m, 1 H) 8.3 (d, J=7.0 Hz, 2H) 8.5 (m, 1 H) 8.8 (s, 2 H) 9.4 (s, 1 H) 13.3 (m, 1 H).ESI/MS (m/e, percent): 332 [(M+1)+, 100]
 

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