Benzene → HCID 86587913, compound

HRID 1113195Notes

Reaction equation

HRID 1113195 reaction equation
[C:18]([CH3:19])([CH3:20])([CH3:21])[NH:22][OH:23].[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][O:7][c:8]2[cH:9][cH:10][c:11]([CH:12]=[O:13])[cH:14][cH:15]2)[cH:16][cH:17]1.[c:24]1([CH3:25])[cH:26][cH:27][c:28]([S:29]([OH:30])(=[O:31])=[O:32])[cH:33][cH:34]1.[cH:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][O:7][c:8]2[cH:9][cH:10][c:11]([CH:12]=[N+:22]([C:18]([CH3:19])([CH3:20])[CH3:21])[O-:23])[cH:14][cH:15]2)[cH:16][cH:17]1

Participants

5

Reactant 4

HCID 241BenzeneHCID 6101p-Toluenesulfonic acidHCID 98586N-tert-butylhydroxylamineHCID 7358604-[(4-Fluorophenyl)methoxy]benzaldehyde

Product 1

HCID 86587913HCID 86587913, compound

Sources & evidence

ORD record
ord-c714a9c6b204462080b53de60898ddb0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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