Acetone → HCID 58880268, compound

HRID 281725Notes

Reaction equation

HRID 281725 reaction equation
[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([N:12]([CH3:13])[S:14](=[O:15])(=[O:16])[c:17]2[cH:18][cH:19][c:20]([O:23][CH2:24][c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[cH:21][cH:22]2)[cH:7][c:8]([CH2:10][Cl:11])[cH:9]1)=[O:31].[CH3:45][CH2:46][O:47][C:48]([CH3:49])=[O:50].[CH3:52][C:53](=[O:54])[CH3:55].[I-:43].[K+:37].[K+:38].[Na+:44].[O-:39][C:40]([O-:41])=[O:42].[OH2:51].[nH:32]1[n:33][cH:34][n:35][cH:36]1>>[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([N:12]([CH3:13])[S:14](=[O:15])(=[O:16])[c:17]2[cH:18][cH:19][c:20]([O:23][CH2:24][c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[cH:21][cH:22]2)[cH:7][c:8]([CH2:10][n:32]2[n:33][cH:34][n:35][cH:36]2)[cH:9]1)=[O:31]

Participants

10

Reactant 9

HCID 180AcetoneHCID 813Potassium Cation2×HCID 923Sodium ionHCID 962WaterHCID 8857Ethyl AcetateHCID 92571H-1,2,4-TriazoleHCID 19660Carbonate IonHCID 30165Iodide IonHCID 58880271HCID 58880271, compound

Product 1

HCID 58880268HCID 58880268, compound

Sources & evidence

ORD record
ord-ad28da039e264f8ca469d7a5ef102856
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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