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Chemical Structure| 40611-85-6 Chemical Structure| 40611-85-6

Structure of 40611-85-6

Chemical Structure| 40611-85-6

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Product Details of [ 40611-85-6 ]

CAS No. :40611-85-6
Formula : C8H11NO2
M.W : 153.18
SMILES Code : CCOC(=O)C1=CC(C)=CN1
MDL No. :MFCD00191668
InChI Key :RWFKYBVNHRKZSN-UHFFFAOYSA-N
Pubchem ID :643361

Safety of [ 40611-85-6 ]

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

Application In Synthesis of [ 40611-85-6 ]

* 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 [ 40611-85-6 ]

[ 40611-85-6 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 7126-57-0 ]
  • [ 40611-85-6 ]
YieldReaction ConditionsOperation in experiment
To a THF (20L) solution of compound 1-A (2kg, 11.96mol) was added p-toluenesulfonamide (2.23kg, 11.96mol).Stir at 20C for about 1 hour.TLC showed that the raw materials disappeared, the reaction system was heated to 60C, and sodium cyanoborohydride (902g, 14.36mol) was added to it in batches. After the addition, the reaction was heated to 70C and stirred for 3h.The heating was stopped, 5L of water was added to quench the reaction after it was cooled to room temperature, most of the THF was removed under reduced pressure, and the remainder was extracted with a large amount of EA (1.5L*3).Combine the organic phases, wash the organic phase with saturated sodium chloride, and dry with anhydrous sodium sulfate.Filter, remove solvent under reduced pressure, crude product column chromatographyA light yellow solid compound 1-B was obtained.
 

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