Hydrochloric Acid → HCID 18619261, compound

HRID 691577Notes

Reaction equation

HRID 691577 reaction equation
[CH3:23][CH2:24][N:25]([CH2:26][CH3:27])[CH2:28][CH3:29].[CH3:40][N:41]([CH3:42])[CH:43]=[O:44].[Cl:1][c:2]1[c:3]([OH:22])[cH:4][c:5](-[n:9]2[c:10](=[O:21])[n:11]([CH3:20])[c:12]([C:16]([F:17])([F:18])[F:19])[cH:13][c:14]2=[O:15])[c:6]([F:8])[cH:7]1.[Cl:30][CH:31]([C:32](=[O:33])[O:34][CH3:35])[C:36](=[O:37])[CH3:38].[ClH:39].[OH2:45]>>[Cl:1][c:2]1[c:3]([O:22][CH:31]([C:32](=[O:33])[O:34][CH3:35])[C:36](=[O:37])[CH3:38])[cH:4][c:5](-[n:9]2[c:10](=[O:21])[n:11]([CH3:20])[c:12]([C:16]([F:17])([F:18])[F:19])[cH:13][c:14]2=[O:15])[c:6]([F:8])[cH:7]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 107332Methyl 2-chloroacetoacetateHCID 112677571-methyl-6-trifluoromethyl-3-(4-chloro-2-fluoro-5-hydroxyphenyl)-2,4(1H,3H)-pyrimidinedione

Product 1

HCID 18619261HCID 18619261, compound

Sources & evidence

ORD record
ord-f47f1d11b44945bdad57a5d008d610f1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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