Benzene → HCID 4438647, compound

HRID 1203057Notes

Reaction equation

HRID 1203057 reaction equation
[Al+3:22].[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([OH:20])[c:7]([CH2:12][c:13]2[c:14]([OH:19])[cH:15][cH:16][cH:17][cH:18]2)[cH:8][c:9]([CH3:11])[cH:10]1.[Cl-:21].[Cl-:23].[Cl-:24].[cH:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[cH:5]1[c:6]([OH:20])[c:7]([CH2:12][c:13]2[c:14]([OH:19])[cH:15][cH:16][cH:17][cH:18]2)[cH:8][c:9]([CH3:11])[cH:10]1

Participants

5

Reactant 4

HCID 241BenzeneHCID 312Chloride3×HCID 104727Aluminum CationHCID 22151948HCID 22151948, compound

Product 1

HCID 4438647HCID 4438647, compound

Sources & evidence

ORD record
ord-da46d5f99c844052a885456c8de13390
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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