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Ethanol → Methyl 7-(3-thienyl)-2,3-dihydro-1-benzoxepine-4-carboxylate

HRID 1553692
Notes
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Reaction equation

HRID 1553692 reaction equation
[B:17]([O-:18])([O-:24])[O:25][c:19]1[cH:20][s:21][cH:22][cH:23]1.[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:16]1)[CH:7]=[C:8]([C:12](=[O:13])[O:14][CH3:15])[CH2:9][CH2:10][O:11]2.[C:26](=[O:27])([O-:28])[O-:29].[CH2:33]([OH:34])[CH3:35].[K+:30].[K+:31].[OH2:32].[c:36]1([CH3:37])[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[c:2]1(-[c:19]2[cH:20][s:21][cH:22][cH:23]2)[cH:3][cH:4][c:5]2[c:6]([cH:16]1)[CH:7]=[C:8]([C:12](=[O:13])[O:14][CH3:15])[CH2:9][CH2:10][O:11]2
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 702EthanolHCID 813Potassium Cation2×HCID 962WaterHCID 1140TolueneHCID 19660Carbonate IonHCID 22990005Methyl 7-bromo-2,3-dihydro-1-benzooxepine-4-carboxylateHCID 867561823-Thienyl borate

Product 1

Sources & evidence

ORD record
ord-0716370fab3a487a86c94c179d33090c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes
HCID 18472510Methyl 7-(3-thienyl)-2,3-dihydro-1-benzoxepine-4-carboxylate