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Chemical Structure| 151917-39-4 Chemical Structure| 151917-39-4

Structure of 151917-39-4

Chemical Structure| 151917-39-4

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Product Details of [ 151917-39-4 ]

CAS No. :151917-39-4
Formula : C8H8INO2
M.W : 277.06
SMILES Code : O=C(OCC)C1=CN=C(I)C=C1
MDL No. :MFCD16556298
InChI Key :KKKHZZOMDYNIKE-UHFFFAOYSA-N
Pubchem ID :10891136

Safety of [ 151917-39-4 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P280-P301+P312-P302+P352-P305+P351+P338

Application In Synthesis of [ 151917-39-4 ]

* 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.

  • Upstream synthesis route of [ 151917-39-4 ]
  • Downstream synthetic route of [ 151917-39-4 ]

[ 151917-39-4 ] Synthesis Path-Upstream   1~1

  • 1
  • [ 151917-39-4 ]
  • [ 1762-46-5 ]
YieldReaction ConditionsOperation in experiment
84% With palladium diacetate; potassium carbonate In N,N-dimethyl-formamide; isopropyl alcohol at 100℃; for 6 h; General procedure: A 100 mL round bottom flask was equipped with a magnetic stir bar and charged with the appropriate aryl iodide (1 equiv), K2CO3 (1.5 equiv), iPrOH (2 equiv), Pd(OAc)2 (5 mol percent), and a sufficient volume of DMF to make a 0.35 M solution. The reaction mixture was placed under nitrogen and heated to 100 C for 2–5 h until the starting material was consumed as judged by TLC analysis. The reaction mixture was cooled to room temperature and brine (40 mL) was added. The resulting mixture was transferred to a separatory funnel and extracted with EtOAc (3 × 75 mL). The organic layers were combined, washed with brine (1 × 75 mL), dried with Na2SO4, and the solvent was removed in vacuo to afford the crude product as a solid. The crude solid was purified by flash column chromatography or by recrystallization.
References: [1] Beilstein Journal of Organic Chemistry, 2015, vol. 11, p. 61 - 65.
 

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