Acetic Acid → HCID 13386231, compound
Reaction equation
[CH3:22][C:23](=[O:24])[OH:25].[Cl:1][c:2]1[n:3][c:4]([N:13]([CH3:14])[c:15]2[cH:16][cH:17][c:18]([OH:21])[cH:19][cH:20]2)[cH:5][c:6]2[cH:7][cH:8][c:9]([Cl:12])[cH:10][c:11]12.[OH2:26].[Zn:27]>>[cH:2]1[n:3][c:4]([N:13]([CH3:14])[c:15]2[cH:16][cH:17][c:18]([OH:21])[cH:19][cH:20]2)[cH:5][c:6]2[cH:7][cH:8][c:9]([Cl:12])[cH:10][c:11]12Participants
5
Sources & evidence
- ORD record
- ord-d149b7ada08e4564b783b29fb80953a6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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