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Chemical Structure| 1260539-00-1 Chemical Structure| 1260539-00-1

Structure of 1260539-00-1

Chemical Structure| 1260539-00-1

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Product Details of [ 1260539-00-1 ]

CAS No. :1260539-00-1
Formula : C9H10IN3
M.W : 287.10
SMILES Code : CC(C1=NNC2=NC=CC(I)=C21)C
MDL No. :MFCD28660700

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Application In Synthesis of [ 1260539-00-1 ]

* 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 [ 1260539-00-1 ]

[ 1260539-00-1 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 1260539-00-1 ]
  • [ 146137-79-3 ]
  • [ 1260539-26-1 ]
YieldReaction ConditionsOperation in experiment
67% With caesium carbonate; In acetonitrile; for 3h;Reflux; Example 125(1)3-Formyl-4-{4-iodo-3-isopropyl-1H-pyrazolo[3,4-b]pyridin-1-yl}benzonitrile (125a)Compound (100a) (2.0 g), cesium carbonate (3.41 g), and <strong>[146137-79-3]4-fluoro-3-formylbenzonitrile</strong> (1.25 g) were suspended in acetonitrile (23 mL), followed by reflux for 3 hr. The reaction solution was distributed between chloroform and water, and the organic layer was washed with saturated saline. The organic layer after the washing was dried over anhydrous sodium sulfate, and then the solvent was distilled away. The residue was purified by neutral silica gel column chromatography (hexane/ethyl acetate) to obtain compound (125a) (2.00 g, 67percent) as a white solid.1H-NMR (DMSO-d6) delta: 9.93 (1H, s), 8.30-8.24 (3H, m), 8.20 (1H, d, J=4.88 Hz), 7.96 (1H, d, J=4.88 Hz), 3.95 (1H, tt, J=6.83, 6.83 Hz), 1.44 (6H, d, J=6.83 Hz); LRMS (ESI) m/z 417 [M+H]+.
 

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