1,2,4-Trichlorobenzene → 4-(4-Fluorobenzoyl)isophthalic acid

HRID 2139595Notes

Reaction equation

HRID 2139595 reaction equation
[Al+3:23].[Cl-:22].[Cl-:24].[Cl-:25].[Cl:27][c:28]1[cH:29][c:30]([Cl:31])[c:32]([Cl:33])[cH:34][cH:35]1.[ClH:26].[F:15][c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1.[OH:1][C:2](=[O:3])[c:4]1[cH:5][cH:6][c:7]2[c:13]([cH:14]1)[C:11](=[O:12])[O:10][C:8]2=[O:9]>>[OH:1][C:2](=[O:3])[c:4]1[cH:5][cH:6][c:7]([C:8](=[O:9])[c:19]2[cH:18][cH:17][c:16]([F:15])[cH:21][cH:20]2)[c:13]([C:11]([OH:10])=[O:12])[cH:14]1

Participants

7

Reactant 6

HCID 131,2,4-TrichlorobenzeneHCID 312Chloride3×HCID 313Hydrochloric AcidHCID 10008FluorobenzeneHCID 11089Trimellitic anhydrideHCID 104727Aluminum Cation

Product 1

HCID 98355864-(4-Fluorobenzoyl)isophthalic acid

Sources & evidence

ORD record
ord-1e0ed9327605447ea289707e0327b8fa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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