Acetic Acid → 2-Chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzaldehyde

HRID 1238353Notes

Reaction equation

HRID 1238353 reaction equation
[CH2:1]=[O:2].[CH3:30][C:31](=[O:32])[OH:33].[CH3:4][O:5][N:6]=[CH:7][c:8]1[c:9]([Cl:28])[cH:10][c:11]([F:27])[c:12](-[n:14]2[c:15](=[O:26])[n:16]([CH3:25])[c:17]([C:21]([F:22])([F:23])[F:24])[cH:18][c:19]2=[O:20])[cH:13]1.[ClH:3].[OH2:29]>>[CH:1](=[O:2])[c:8]1[c:9]([Cl:28])[cH:10][c:11]([F:27])[c:12](-[n:14]2[c:15](=[O:26])[n:16]([CH3:25])[c:17]([C:21]([F:22])([F:23])[F:24])[cH:18][c:19]2=[O:20])[cH:13]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 712FormaldehydeHCID 962WaterHCID 538363112-Chloro-4-fluoro-5-(1-methyl-6-trifluoromethyl-2,4(1H,3H)-pyrimidinedion-3-yl)benzaldehyde (O-methyl)oxime

Product 1

HCID 212012522-Chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzaldehyde

Sources & evidence

ORD record
ord-1a733a2f5c6945b0826a819249e6085c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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