Acetic Acid → HCID 86601163, compound
Reaction equation
[CH3:30][C:31](=[O:32])[OH:33].[Cl:1][C:2](=[C:3]([Cl:4])[Cl:5])[c:6]1[cH:7][c:8]([OH:12])[cH:9][cH:10][cH:11]1.[Na+:29].[O-:25][C:26]([OH:27])=[O:28].[OH:13][CH2:14][NH:15][C:16]([CH2:17][Cl:18])=[O:19].[S:20](=[O:21])(=[O:22])([OH:23])[OH:24]>>[Cl:1][C:2](=[C:3]([Cl:4])[Cl:5])[c:6]1[cH:7][c:8]([OH:12])[c:9]([CH2:14][NH:15][C:16]([CH2:17][Cl:18])=[O:19])[cH:10][cH:11]1Participants
7
Sources & evidence
- ORD record
- ord-94f9e8bad0c14135b03895b756d4aca7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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