Ethanol → Epyrifenacil

HRID 1546813Notes

Reaction equation

HRID 1546813 reaction equation
[CH3:41][CH2:42][OH:43].[Cl:1][c:2]1[c:3]([O:4][c:5]2[c:6]([O:11][CH2:12][C:13](=[O:14])[O:15][CH3:16])[n:7][cH:8][cH:9][cH:10]2)[cH:17][c:18](-[n:22]2[c:23](=[O:34])[n:24]([CH3:33])[c:25]([C:29]([F:30])([F:31])[F:32])[cH:26][c:27]2=[O:28])[c:19]([F:21])[cH:20]1.[Na+:35].[Na+:36].[O-:37][C:38](=[O:39])[O-:40]>>[Cl:1][c:2]1[c:3]([O:4][c:5]2[c:6]([O:11][CH2:12][C:13](=[O:14])[O:15][CH2:16][CH3:38])[n:7][cH:8][cH:9][cH:10]2)[cH:17][c:18](-[n:22]2[c:23](=[O:34])[n:24]([CH3:33])[c:25]([C:29]([F:30])([F:31])[F:32])[cH:26][c:27]2=[O:28])[c:19]([F:21])[cH:20]1

Participants

5

Reactant 4

HCID 702EthanolHCID 923Sodium ion2×HCID 19660Carbonate IonHCID 120567393-[2-Chloro-4-fluoro-5-(3-methyl-2,6-dioxo-4-trifluoromethyl-1,2,3,6-tetrahydropyrimidin-1-yl)phenoxy]-2-(methoxycarbonylmethoxy)pyridine

Product 1

HCID 12097345Epyrifenacil

Sources & evidence

ORD record
ord-1cbcb990eb654be3be0f0e14ac9a9746
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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