Benzene → 5-t-Butyl-2-(4-ethynylphenyl)-1,3-oxathiane
Reaction equation
[C:10](#[CH:11])[c:12]1[cH:13][cH:14][c:15]([CH:16]=[O:17])[cH:18][cH:19]1.[CH3:1][C:2]([CH:3]([CH2:4][OH:5])[CH2:6][SH:7])([CH3:8])[CH3:9].[c:20]1([CH3:21])[cH:22][cH:23][c:24]([S:25]([OH:26])(=[O:27])=[O:28])[cH:29][cH:30]1.[cH:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[CH3:1][C:2]([CH:3]1[CH2:4][O:5][CH:16]([c:15]2[cH:14][cH:13][c:12]([C:10]#[CH:11])[cH:19][cH:18]2)[S:7][CH2:6]1)([CH3:8])[CH3:9]Participants
5
Sources & evidence
- ORD record
- ord-2e6c16f5cf8a4504b08fa56962ffd380
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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