ethyl 7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxylate

Base Information

Chemical Name:ethyl 7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxylate
CAS No.:229007-83-4
Molecular Formula:C₂₀H₁₇F₃O₃
Molecular Weight:362.348
Hs Code.:

Synonyms:ethyl 7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxylate

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Chemical Property of ethyl 7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxylate

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Technology Process of ethyl 7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxylate

There total 7 articles about ethyl 7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxylate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 80.0%

: 128796-39-4
4-trifluoromethylphenylboronic acid

: 229007-43-6
ethyl 7-bromo-2,3-dihydro-1-benzoxepine-4-carboxylate

: 229007-83-4
ethyl 7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxylate

Guidance literature:: With tetrakis(triphenylphosphine) palladium⁽⁰⁾; potassium carbonate; In ethanol; toluene; Heating;
DOI:10.1021/jm9906264

Reference yield:

: 1079366-57-6
tris(p-(trifluoromethyl)phenyl) borate

: 229007-43-6
ethyl 7-bromo-2,3-dihydro-1-benzoxepine-4-carboxylate

: 229007-83-4
ethyl 7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxylate

Guidance literature:: With potassium carbonate; tetrakis(triphenylphosphine)palladium ⁽⁰⁾; In toluene-ethanol-water;

Reference yield:

: 2969-81-5
Ethyl 4-bromobutyrate

: 229007-83-4
ethyl 7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxylate

Guidance literature:: Multi-step reaction with 5 steps

1: 87 percent / K₂CO₃ / dimethylformamide / 20 °C

2: lithium diisopropylamide / hexane; tetrahydrofuran / -78 - 20 °C

3: NaBH₄ / methanol; CH₂Cl₂ / 1 h / -10 °C

4: 41 percent / methanesulfonyl chloride; Et₃N / CH₂Cl₂ / 20 °C

5: 80 percent / tetrakis(triphenylphosphine)palladium; 2 M aq. K₂CO₃ / ethanol; toluene / Heating

With sodium tetrahydroborate; tetrakis(triphenylphosphine) palladium⁽⁰⁾; potassium carbonate; methanesulfonyl chloride; triethylamine; lithium diisopropyl amide; In tetrahydrofuran; methanol; ethanol; hexane; dichloromethane; N,N-dimethyl-formamide; toluene; 1: Alkylation / 2: Dieckmann condensation / 3: Reduction / 4: Dehydration / 5: Suzuki coupling;
DOI:10.1021/jm9906264