Acetone → HCID 58111179, compound

HRID 699806Notes

Reaction equation

HRID 699806 reaction equation
[C:25](=[O:26])([O-:27])[O-:28].[CH3:23][I:24].[CH3:31][C:32](=[O:33])[CH3:34].[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6]([C:8]#[C:9][c:10]2[n:11][c:12]([CH3:22])[n:13](-[c:15]3[cH:16][c:17](=[O:21])[nH:18][cH:19][n:20]3)[cH:14]2)[cH:7]1.[K+:29].[K+:30]>>[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6]([C:8]#[C:9][c:10]2[n:11][c:12]([CH3:22])[n:13](-[c:15]3[cH:16][c:17](=[O:21])[n:18]([CH3:25])[cH:19][n:20]3)[cH:14]2)[cH:7]1

Participants

6

Reactant 5

HCID 180AcetoneHCID 813Potassium Cation2×HCID 6328Methyl iodideHCID 19660Carbonate IonHCID 136395140HCID 136395140, compound

Product 1

HCID 58111179HCID 58111179, compound

Sources & evidence

ORD record
ord-655d34af934d4ac4b237f23cdcda78c7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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