Ethanol → 2-Chloro-8-(1-hydroxaminoethyl)phenoxathiin
Reaction equation
[BH3:20].[CH2:30]1[O:31][CH2:32][CH2:33][CH2:34]1.[CH3:27][CH2:28][OH:29].[Cl:1][c:2]1[cH:3][c:4]2[c:13]([cH:14][cH:15]1)[O:12][c:11]1[c:6]([cH:7][c:8]([C:16]([CH3:17])=[N:18][OH:19])[cH:9][cH:10]1)[S:5]2.[n:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1>>[Cl:1][c:2]1[cH:3][c:4]2[c:13]([cH:14][cH:15]1)[O:12][c:11]1[c:6]([cH:7][c:8]([CH:16]([CH3:17])[NH:18][OH:19])[cH:9][cH:10]1)[S:5]2Participants
6
Sources & evidence
- ORD record
- ord-a41c700427cf425fadf1de3faf5489c2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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