Potassium Cation → Methyl 7-[(2-chlorobenzyl)oxy]-1,1-dioxo-2,3-dihydro-1-benzothiepine-4-carboxylate

HRID 116718

Reaction equation

HRID 116718 reaction equation
[C:28](=[O:29])([O-:30])[O-:31].[Cl:19][c:20]1[c:21]([CH2:22][Cl:23])[cH:24][cH:25][cH:26][cH:27]1.[K+:32].[K+:33].[O:34]=[CH:35][N:36]([CH3:37])[CH3:38].[OH2:39].[OH: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]>>[O: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])[CH2:22][c:21]1[c:20]([Cl:19])[cH:27][cH:26][cH:25][cH:24]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 962WaterHCID 6228DimethylformamideHCID 119062-Chlorobenzyl chlorideHCID 19660Carbonate IonHCID 22989977Methyl 7-hydroxy-1,1-dioxo-2,3-dihydro-1-benzothiepine-4-carboxylate

Product 1

HCID 22990149Methyl 7-[(2-chlorobenzyl)oxy]-1,1-dioxo-2,3-dihydro-1-benzothiepine-4-carboxylate

Sources & evidence

ORD record
ord-c106ba8a47084514a6e04c6fbc0c5144
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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