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Chemical Structure| 127299-26-7 Chemical Structure| 127299-26-7

Structure of 127299-26-7

Chemical Structure| 127299-26-7

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Product Details of [ 127299-26-7 ]

CAS No. :127299-26-7
Formula : C13H13NO
M.W : 199.25
SMILES Code : COC1=CC2=C(CCC/C2=C\C#N)C=C1

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Application In Synthesis of [ 127299-26-7 ]

* 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 [ 127299-26-7 ]

[ 127299-26-7 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 127299-26-7 ]
  • [ 138113-08-3 ]
YieldReaction ConditionsOperation in experiment
50.9 g With orthocarbonic acid tetraethyl ester; benzyl formate; palladium 10% on activated carbon; In toluene; for 0.1h;Reflux; Was introduced into the toluene layer of the compound of formula IV prepared in Example 15.6 g of 10% Pd / C (i.e., 10% palladium in palladium on carbon reagent)27.6 g of tetraethyl ortho carbonate,38.7gFormic acid benzyl ester,Reflux dehydration reaction to the basic reaction of raw materials completely,About 10h,Cooled to 60 or less,FiltrationWashed with 300 ml of water,Separate the water layer,Steamed toluene,The temperature was raised to 60 C by adding 250 ml of cyclohexane, Dissolved,Cooling,The resulting mixture was filtered through suction filtration to obtain 51.5 g of the compound of the formula I,The compound of formula I of Example 10 was heated to 60 C in a mass fraction of 80% ethanol 200 ml,Cooling to 50 heat 1h, continue to cool to 0-5 heat 2h, filtered to be refined after the high purity compound I 50.9g, purity 99.9%. The yield of the compound of formula I was calculated to be 90.9% based on the formula III compound. Melting point: 83 to 84 C.
62.4 g With DBC; Benzyl acetate; benzyl pentanoate; palladium 10% on activated carbon; In toluene; for 0.1h;Reflux; (2) To a solution of formula XIThe toluene layer compound into10% Pd / C (ie palladium carbon reagent in the mass fraction of 10% palladium) 6g,33 g of benzyl acetate,42.3 g of benzyl valerate,53.3 g of dibenzyl carbonate,Reflux dehydration reaction to the basic reaction of raw materials completely,About 10h,Cooled to 60 C or less,300 ml of water was charged,Filtration,Separate the water layer, Steamed toluene,The temperature was raised to 60 C by adding 250 ml of cyclohexane, Dissolved,Cooling,The filtrate was filtered to obtain 62.4 g of the compound of formula I,purity:99.2%, The yield of the compound of formula I calculated from the compound of formula III was 92.9%.
 

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