Acetone → UK-333747

HRID 2335786Notes

Reaction equation

HRID 2335786 reaction equation
[CH3:40][C:41](=[O:42])[CH3:43].[Cl:12][c:13]1[c:14](-[n:26]2[c:27]([CH2:37][O:38][CH3:39])[n:28][n:29][c:30]2-[c:31]2[cH:32][n:33][cH:34][cH:35][cH:36]2)[c:15]2[nH:16][c:17](=[O:25])[c:18](=[O:24])[nH:19][c:20]2[cH:21][c:22]1[Cl:23].[OH:1][O:2][C:3]([c:4]1[cH:5][c:6]([Cl:7])[cH:8][cH:9][cH:10]1)=[O:11]>>[O-:1][n+:33]1[cH:32][c:31](-[c:30]2[n:26](-[c:14]3[c:13]([Cl:12])[c:22]([Cl:23])[cH:21][c:20]4[c:15]3[nH:16][c:17](=[O:25])[c:18](=[O:24])[nH:19]4)[c:27]([CH2:37][O:38][CH3:39])[n:28][n:29]2)[cH:36][cH:35][cH:34]1

Participants

4

Reactant 3

HCID 180AcetoneHCID 70297m-Chloroperbenzoic acidHCID 9802164HCID 9802164, compound

Product 1

HCID 9867605UK-333747

Sources & evidence

ORD record
ord-9fed2aa190c8466cb05048179157cec8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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