Water → HCID 67253540, compound

HRID 2127423Notes

Reaction equation

HRID 2127423 reaction equation
[C:11]([CH2:12][C:13](=[O:14])[CH3:15])(=[O:16])[O:17][CH3:18].[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[Cl:1][c:2]1[cH:3][c:4]([CH3:10])[c:5]([NH2:6])[c:7]([CH3:9])[cH:8]1.[OH2:19].[c:20]1([CH3:21])[cH:22][cH:23][c:24]([S:25]([OH:26])(=[O:27])=[O:28])[cH:29][cH:30]1>>[Cl:1][c:2]1[cH:3][c:4]([CH3:10])[c:5]([NH:6][C:13](=[CH:12][C:11](=[O:16])[O:17][CH3:18])[CH3:15])[c:7]([CH3:9])[cH:8]1

Participants

6

Reactant 5

HCID 962WaterHCID 1140TolueneHCID 6101p-Toluenesulfonic acidHCID 7757Methyl acetoacetateHCID 50733624-Chloro-2,6-dimethylaniline

Product 1

HCID 67253540HCID 67253540, compound

Sources & evidence

ORD record
ord-8c16bedfb21d4c0cacb65c5d433ba450
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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