Hydrochloric Acid → HCID 18759320, compound

HRID 1134685Notes

Reaction equation

HRID 1134685 reaction equation
[C:10](=[O:11])([O-:12])[O-:13].[CH3:1][O:2][c:3]1[cH:4][cH:5][cH:6][c:7]([OH:8])[cH:9]1.[CH3:42][N:43]([CH3:44])[CH:45]=[O:46].[ClH:40].[F:16][c:17]1[c:18]([N+:37](=[O:38])[O-:39])[cH:19][c:20]([F:36])[c:21](-[n:23]2[c:24](=[O:35])[n:25]([CH3:34])[c:26]([C:30]([F:31])([F:32])[F:33])[cH:27][c:28]2=[O:29])[cH:22]1.[K+:14].[K+:15].[OH2:41]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][cH:6][c:7]([O:8][c:17]2[c:18]([N+:37](=[O:38])[O-:39])[cH:19][c:20]([F:36])[c:21](-[n:23]3[c:24](=[O:35])[n:25]([CH3:34])[c:26]([C:30]([F:31])([F:32])[F:33])[cH:27][c:28]3=[O:29])[cH:22]2)[cH:9]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 813Potassium Cation2×HCID 962WaterHCID 6228DimethylformamideHCID 90073-MethoxyphenolHCID 19660Carbonate IonHCID 121155092,5-Difluoro-4-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrahydropyrimidin-1-yl]nitrobenzene

Product 1

HCID 18759320HCID 18759320, compound

Sources & evidence

ORD record
ord-175d4beb1edb4945b2b48e947dd93475
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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