Ethanol → 3-[4-(5-tert-Butyl-2-methyl-phenylethynyl)-phenyl]-acrylic acid
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]=[CH:6][c:7]1[cH:8][cH:9][c:10]([C:13]#[C:14][c:15]2[c:16]([CH3:25])[cH:17][cH:18][c:19]([C:21]([CH3:22])([CH3:23])[CH3:24])[cH:20]2)[cH:11][cH:12]1)=[O:26].[CH3:29][CH2:30][OH:31].[K+:28].[O:32]1[CH2:33][CH2:34][CH2:35][CH2:36]1.[OH-:27]>>[O:3]=[C:4]([CH:5]=[CH:6][c:7]1[cH:8][cH:9][c:10]([C:13]#[C:14][c:15]2[c:16]([CH3:25])[cH:17][cH:18][c:19]([C:21]([CH3:22])([CH3:23])[CH3:24])[cH:20]2)[cH:11][cH:12]1)[OH:26]Participants
6
Sources & evidence
- ORD record
- ord-5973fcdd1ddd449a9a8e4f0abe095632
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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