Chloride → HCID 13663047, compound

HRID 678728Notes

Reaction equation

HRID 678728 reaction equation
[Al+3:17].[Br:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([s:8][c:9]([C:12](=[O:13])[OH:14])[c:10]2[Cl:11])[cH:15]1.[CH:30]([Cl:31])([Cl:32])[Cl:33].[Cl-:1].[H-:16].[H-:19].[H-:20].[H-:21].[Li+:18].[Na+:24].[O:25]1[CH2:26][CH2:27][CH2:28][CH2:29]1.[OH-:23].[OH2:22]>>[Br:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([s:8][c:9]([CH2:12][OH:13])[c:10]2[Cl:11])[cH:15]1

Participants

11

Reactant 10

HCID 312ChlorideHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6212ChloroformHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 104727Aluminum CationHCID 166653Hydride4×HCID 8418196-Bromo-3-chloro-1-benzothiophene-2-carboxylic acid

Product 1

HCID 13663047HCID 13663047, compound

Sources & evidence

ORD record
ord-6cebf4ca3a4e4a768da78e479c7f4964
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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