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Ethanol → Methyl 7-(4-methyl-2-thienyl)-1,1-dioxo-2,3-dihydro-1-benzothiepine-4-carboxylate

HRID 959885
Notes
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Reaction equation

HRID 959885 reaction equation
[B:19]([O-:20])([O-:27])[O:28][c:21]1[s:22][cH:23][c:24]([CH3:26])[cH:25]1.[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:18]1)[CH:7]=[C:8]([C:14](=[O:15])[O:16][CH3:17])[CH2:9][CH2:10][S:11]2(=[O:12])=[O:13].[C:29](=[O:30])([O-:31])[O-:32].[CH2:37]([OH:38])[CH3:39].[K+:33].[K+:34].[OH2:35].[OH2:36].[c:40]1([CH3:41])[cH:42][cH:43][cH:44][cH:45][cH:46]1>>[c:2]1(-[c:21]2[s:22][cH:23][c:24]([CH3:26])[cH:25]2)[cH:3][cH:4][c:5]2[c:6]([cH:18]1)[CH:7]=[C:8]([C:14](=[O:15])[O:16][CH3:17])[CH2:9][CH2:10][S:11]2(=[O:12])=[O:13]
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 702EthanolHCID 813Potassium Cation2×HCID 962Water2×HCID 1140TolueneHCID 19660Carbonate IonHCID 21995732Methyl 7-bromo-1,1-dioxo-2,3-dihydro-1-benzothiepine-4-carboxylateHCID 86756174
4-Methyl-thiophenyl borate

Product 1

HCID 21995692Methyl 7-(4-methyl-2-thienyl)-1,1-dioxo-2,3-dihydro-1-benzothiepine-4-carboxylate

Sources & evidence

ORD record
ord-8eb945a27954456aa5621c555fb43780
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes