Acetic Acid → HCID 59323483, compound
Reaction equation
[CH3:30][C:31](=[O:32])[OH:33].[Cl:1][c:2]1[c:3]([NH:9][C:10](=[O:11])[c:12]2[c:13]([S:25][CH3:26])[nH:14][c:15]3[c:16]([Cl:24])[cH:17][c:18]([Cl:23])[cH:19][c:20]3[c:21]2=[O:22])[cH:4][cH:5][c:6]([Cl:8])[cH:7]1.[OH2:29].[OH:27][OH:28]>>[Cl:1][c:2]1[c:3]([NH:9][C:10](=[O:11])[c:12]2[c:13]([S:25]([CH3:26])=[O:27])[nH:14][c:15]3[c:16]([Cl:24])[cH:17][c:18]([Cl:23])[cH:19][c:20]3[c:21]2=[O:22])[cH:4][cH:5][c:6]([Cl:8])[cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-ad4d27890b5d4c1a852873c60f65a33f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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