Hydrochloric Acid → Ethyl [2-{2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrahydropyrimidin-1-yl]phenoxy}phenoxy]acetate

HRID 202178Notes

Reaction equation

HRID 202178 reaction equation
[C:35](=[O:36])([O-:37])[O-:38].[CH3:41][I:42].[CH3:44][N:45]([CH3:46])[CH:47]=[O:48].[Cl:1][c:2]1[c:3]([O:4][c:5]2[c:6]([O:7][CH2:8][C:9](=[O:10])[O:11][CH2:12][CH3:13])[cH:14][cH:15][cH:16][cH:17]2)[cH:18][c:19](-[n:23]2[c:24](=[O:34])[nH:25][c:26]([C:30]([F:31])([F:32])[F:33])[cH:27][c:28]2=[O:29])[c:20]([F:22])[cH:21]1.[ClH:43].[K+:39].[K+:40]>>[Cl:1][c:2]1[c:3]([O:4][c:5]2[c:6]([O:7][CH2:8][C:9](=[O:10])[O:11][CH2:12][CH3:13])[cH:14][cH:15][cH:16][cH:17]2)[cH:18][c:19](-[n:23]2[c:24](=[O:34])[n:25]([CH3:35])[c:26]([C:30]([F:31])([F:32])[F:33])[cH:27][c:28]2=[O:29])[c:20]([F:22])[cH:21]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 6328Methyl iodideHCID 19660Carbonate IonHCID 17812334Ethyl [2-{2-chloro-4-fluoro-5-[2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrahydropyrimidin-1-yl]phenoxy}phenoxy]acetate

Product 1

HCID 17812341Ethyl [2-{2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrahydropyrimidin-1-yl]phenoxy}phenoxy]acetate

Sources & evidence

ORD record
ord-729fafff39044c4dbdd27863d69ae633
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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