Acetic Acid → HCID 86760481, compound
Reaction equation
[C:6]([CH3:7])(=[O:8])[O:9][c:10]1[c:11]([CH3:26])[c:12]([Cl:25])[c:13]([O:17][c:18]2[cH:19][cH:20][c:21]([NH2:24])[cH:22][cH:23]2)[c:14]([Cl:16])[cH:15]1.[CH3:28][C:29](=[O:30])[OH:31].[CH3:32][C:33](=[O:34])[CH3:35].[Ca+2:3].[Cl:1][O-:2].[Cl:4][O-:5].[OH2:27]>>[Cl:1][c:20]1[cH:19][c:18]([O:17][c:13]2[c:12]([Cl:25])[c:11]([CH3:26])[c:10]([O:9][C:6]([CH3:7])=[O:8])[cH:15][c:14]2[Cl:16])[cH:23][cH:22][c:21]1[NH2:24]Participants
7
Sources & evidence
- ORD record
- ord-0e7ca5cb16af448c8b3d5e31c13b5c5a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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