Acetone → HCID 12112402, compound

HRID 182349Notes

Reaction equation

HRID 182349 reaction equation
[CH3:32][C:33](=[O:34])[CH3:35].[Cl:1][c:2]1[c:3](-[c:8]2[o:9][c:10]([CH:26]([CH3:27])[CH3:28])[c:11]([CH2:13][CH2:14][O:15][S:16]([c:17]3[cH:18][cH:19][c:20]([CH3:21])[cH:22][cH:23]3)(=[O:24])=[O:25])[n:12]2)[cH:4][cH:5][cH:6][cH:7]1.[I-:30].[Na+:29].[OH2:31]>>[Cl:1][c:2]1[c:3](-[c:8]2[o:9][c:10]([CH:26]([CH3:27])[CH3:28])[c:11]([CH2:13][CH2:14][I:30])[n:12]2)[cH:4][cH:5][cH:6][cH:7]1

Participants

6

Reactant 5

HCID 180AcetoneHCID 923Sodium ionHCID 962WaterHCID 30165Iodide IonHCID 12112401HCID 12112401, compound

Product 1

HCID 12112402HCID 12112402, compound

Sources & evidence

ORD record
ord-e4d1e287b44e459ebca1a2337c3d7513
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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