Acetone → 6-(2-Imidazol-1-yl-pyridin-4-yl)-2,2-dimethyl-[1,3]dioxin-4-one

HRID 107956Notes

Reaction equation

HRID 107956 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][C:8](=[O:9])[c:10]1[cH:11][c:12](-[n:16]2[cH:17][n:18][cH:19][cH:20]2)[n:13][cH:14][cH:15]1)=[O:21].[CH3:42][C:43](=[O:44])[CH3:45].[F:22][C:23]([F:24])([F:25])[C:26]([O:27][C:28](=[O:29])[C:30]([F:31])([F:32])[F:33])=[O:34].[F:35][C:36]([F:37])([F:38])[C:39]([OH:40])=[O:41]>>[C:1]1([CH3:2])([CH3:3])[O:5][C:6](=[O:21])[CH:7]=[C:8]([c:10]2[cH:11][c:12](-[n:16]3[cH:17][n:18][cH:19][cH:20]3)[n:13][cH:14][cH:15]2)[O:9]1

Participants

5

Reactant 4

HCID 180AcetoneHCID 6422Trifluoroacetic acidHCID 9845Trifluoroacetic anhydrideHCID 69592810HCID 69592810, compound

Product 1

HCID 222248626-(2-Imidazol-1-yl-pyridin-4-yl)-2,2-dimethyl-[1,3]dioxin-4-one

Sources & evidence

ORD record
ord-22391d8225c04d28ba764d2dbfad95cd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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