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Chemical Structure| 79205-04-2 Chemical Structure| 79205-04-2

Structure of 79205-04-2

Chemical Structure| 79205-04-2

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Product Details of [ 79205-04-2 ]

CAS No. :79205-04-2
Formula : C11H11NO
M.W : 173.21
SMILES Code : COC1=CC=CC2=C1C=CC(C)=N2
MDL No. :MFCD18452218
InChI Key :OQPWQOOLGQWRAL-UHFFFAOYSA-N
Pubchem ID :11332747

Safety of [ 79205-04-2 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P305+P351+P338

Application In Synthesis of [ 79205-04-2 ]

* 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 [ 79205-04-2 ]

[ 79205-04-2 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 79205-04-2 ]
  • [ 5780-66-5 ]
  • C16H13N3O [ No CAS ]
YieldReaction ConditionsOperation in experiment
82% With toluene-4-sulfonamide; In toluene; at 120℃; for 12h;Inert atmosphere; A solution of 5-methoxy-2-methylquinoline (100 mg, 0.57 mmol), p-toluenesulfonamide (98.85 mg, 0.57 mmol) and pyrazine-2-carbaldehyde (61.5 mg, 0.57 mmol) in toluene (0.5 mL) was refluxed at 120° C. for 12 h in a reaction tube under nitrogen. After the mixture was cooled to room temperature, the solvent was removed under reduced pressure. Then the concentrate was purified by column chromatography with EtOAc/DCM (1:2, v/v) on silica gel, affording TZ-23-18 (123 mg, 82percent). 1H-NMR (400 MHz, CDCl3): delta 8.75 (d, J=1.4 Hz, 1H), 8.64-8.50 (m, 1H), 8.43 (d, J=2.4 Hz, 1H), 8.09 (dd, J=46.9, 23.7 Hz, 2H), 7.81 (dd, J=47.4, 15.9 Hz, 2H), 7.71-7.61 (m, 1H), 7.54-7.38 (m, 1H), 6.93 (s, 1H), 4.07 (s, 3H). 13C NMR (101 MHz, CDCl3) delta 162.64, 155.53, 150.61, 149.06, 144.48, 144.30, 143.44, 135.26, 130.20, 129.38, 128.91, 125.79, 121.69, 120.89, 99.32, 55.66.
 

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