Acetone → HCID 178526453, compound

HRID 87922

Reaction equation

HRID 87922 reaction equation
[Br:12][c:13]1[cH:14][c:15]([N+:20](=[O:21])[O-:22])[c:16]([OH:19])[n:17][cH:18]1.[C:23](=[O:24])([O-:25])[O-:26].[CH3:42][C:43](=[O:44])[CH3:45].[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:8][B:9]([OH:10])[OH:11])[cH:6][cH:7]1.[Na+:27].[Na+:28].[OH2:46].[OH:29][C:30]([CH2:31][C:32]([C:33](=[O:34])[OH:35])([CH2:36][C:37](=[O:38])[OH:39])[OH:40])=[O:41]>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:13]2[cH:14][c:15]([N+:20](=[O:21])[O-:22])[c:16]([OH:19])[n:17][cH:18]2)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 180AcetoneHCID 311Citric AcidHCID 923Sodium ion2×HCID 962WaterHCID 19660Carbonate IonHCID 17810664p-Chlorophenylboric acidHCID 178418997HCID 178418997, compound

Product 1

HCID 178526453HCID 178526453, compound

Sources & evidence

ORD record
ord-e1ab8c6803d844efb9d67bdcf2bd3a5e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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