Bicarbonate Ion → 4-Chloro-2-(4-hydroxy-phenyl)-7-methoxy-benzofuran-5-ol

HRID 2319448Notes

Reaction equation

HRID 2319448 reaction equation
[CH3:39][C:40]#[N:41].[Cl:20][N:21]1[C:22](=[O:23])[CH2:24][CH2:25][C:26]1=[O:27].[Na+:32].[Na+:33].[Na+:38].[O-:34][C:35]([OH:36])=[O:37].[OH:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[o:9][c:10]3[c:11]([cH:12]2)[cH:13][c:14]([OH:19])[cH:15][c:16]3[O:17][CH3:18])[cH:6][cH:7]1.[S:28]([O-:29])([O-:30])=[O:31]>>[OH:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[o:9][c:10]3[c:11]([cH:12]2)[c:13]([Cl:20])[c:14]([OH:19])[cH:15][c:16]3[O:17][CH3:18])[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ion3×HCID 1099SulfiteHCID 6342AcetonitrileHCID 31398ChlorosuccinimideHCID 102860222-(4-Hydroxy-phenyl)-7-methoxy-benzofuran-5-ol

Product 1

HCID 101930274-Chloro-2-(4-hydroxy-phenyl)-7-methoxy-benzofuran-5-ol

Sources & evidence

ORD record
ord-a0452335dcfd4f598d5cd70574ff4413
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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