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Chemical Structure| 313655-84-4 Chemical Structure| 313655-84-4

Structure of 313655-84-4

Chemical Structure| 313655-84-4

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Product Details of [ 313655-84-4 ]

CAS No. :313655-84-4
Formula : C9H9F3O3
M.W : 222.16
SMILES Code : OCCOC1=CC=CC(OC(F)(F)F)=C1
MDL No. :MFCD27949210

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Application In Synthesis of [ 313655-84-4 ]

* 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.

  • Downstream synthetic route of [ 313655-84-4 ]

[ 313655-84-4 ] Synthesis Path-Downstream   1~2

  • 1
  • [ 827-99-6 ]
  • [ 313655-84-4 ]
YieldReaction ConditionsOperation in experiment
0.75 g (60%) Step 1: 2-[3-(Trifluoromethoxy)phenoxy]ethanol. The title product was prepared according to the procedure described in Example 91, Step 1, starting from <strong>[827-99-6]3-trifluoromethoxyphenol</strong>. Oil; yield 0.75 g (60percent); MS m/z 222 (M)+. Anal. (C9H9F3O3) C, H.
  • 2
  • [ 827-99-6 ]
  • [ 540-51-2 ]
  • [ 313655-84-4 ]
YieldReaction ConditionsOperation in experiment
94.5% With potassium carbonate; In N,N-dimethyl-formamide; at 80℃; Intermediate 5 2-(3-(trifluoromethoxy)phenoxy)ethanol To a solution of <strong>[827-99-6]3-(trifluoromethoxy)phenol</strong>(3 g, 16.8 mmol) in DMF (30 mL) was added 2- bromoethanol (3.16 g, 25.3 mmol), potassium carbonate(4.65 g, 33.7 mmol). The mixture was heated at 80 °C overnight. The mixture was cooled, partitioned between ethyl acetate and water. The organic layers were combined, dried over sodium sulfate, filtered and concentrated to give a crude product which was purified by a column chromatography eluting with petroleum ether and ethyl acetate(10: l) to give 2-(3-(trifluoromethoxy)phenoxy)ethanol (3.5 g, 94.5 percent yield) as a yellow oil. 'H-NMR (DMSO-i/6) delta 7.28-7.30 (t, 1H), 6.81 -6.86 (m, 2H), 6.78 (s, 1 H), 4.07-4.09 (t, 2H), 3.95-3.99 (m, 2H), 2.58 (t, 1H).
94.5% With potassium carbonate; In N,N-dimethyl-formamide; at 80℃; To a solution of <strong>[827-99-6]3-(trifluoromethoxy)phenol</strong> (3 g, 16.8 mmol) in DMF (30 mL) was added 2-bromoethanol (3.16 g, 25.3 mmol), potassium carbonate (4.65 g, 33.7 mmol). The mixture was heated at 80° C. overnight. The mixture was cooled, partitioned between ethyl acetate and water. The organic layers were combined, dried over sodium sulfate, filtered and concentrated to give a crude product which was purified by a column chromatography eluting with petroleum ether/methanol (60:1 to 30:1) to give 2-(3-(trifluoromethoxy)phenoxy)ethanol (3.5 g, 94.5percent yield) as a yellow oil. 1H-NMR 1H-NMR (DMSO-d6) delta 7.28-7.30 (t, 1H), 6.81-6.86 (m, 2H), 6.78 (s, 1H), 4.07-4.09 (t, 2H), 3.95-3.99 (m, 2H), 2.58 (t, 1H).
 

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