Ethanol → Ethyl 7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxylate

HRID 961873Notes

Reaction equation

HRID 961873 reaction equation
[B:18]([O-:19])([O-:30])[O:31][c:20]1[cH:21][cH:22][c:23]([C:26]([F:27])([F:28])[F:29])[cH:24][cH:25]1.[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:17]1)[CH:7]=[C:8]([C:12](=[O:13])[O:14][CH2:15][CH3:16])[CH2:9][CH2:10][O:11]2.[C:32](=[O:33])([O-:34])[O-:35].[CH2:39]([OH:40])[CH3:41].[K+:36].[K+:37].[OH2:38].[c:42]1([CH3:43])[cH:44][cH:45][cH:46][cH:47][cH:48]1>>[c:2]1(-[c:20]2[cH:21][cH:22][c:23]([C:26]([F:27])([F:28])[F:29])[cH:24][cH:25]2)[cH:3][cH:4][c:5]2[c:6]([cH:17]1)[CH:7]=[C:8]([C:12](=[O:13])[O:14][CH2:15][CH3:16])[CH2:9][CH2:10][O:11]2

Participants

8

Reactant 7

HCID 702EthanolHCID 813Potassium Cation2×HCID 962WaterHCID 1140TolueneHCID 19660Carbonate IonHCID 10709089HCID 10709089, compoundHCID 867561674-Trifluoromethylphenyl borate

Product 1

HCID 10808612Ethyl 7-(4-trifluoromethylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxylate

Sources & evidence

ORD record
ord-c5712aead52d42c8ac54f5d0befdea1a
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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