Hydrochloric Acid → 3-Ethynyl-1-[3-(trifluoromethyl)phenyl]pyridazin-4(1H)-one
Reaction equation
[CH3:25][OH:26].[ClH:24].[F:1][C:2]([c:3]1[cH:4][c:5](-[n:9]2[n:10][c:11]([C:16]#[C:17][Si:18]([CH3:19])([CH3:20])[CH3:21])[c:12](=[O:15])[cH:13][cH:14]2)[cH:6][cH:7][cH:8]1)([F:22])[F:23].[Na+:28].[OH-:27]>>[F:1][C:2]([c:3]1[cH:4][c:5](-[n:9]2[n:10][c:11]([C:16]#[CH:17])[c:12](=[O:15])[cH:13][cH:14]2)[cH:6][cH:7][cH:8]1)([F:22])[F:23]Participants
6
Sources & evidence
- ORD record
- ord-eb2111f2e88c49cabce3d84f6b45dc59
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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