Acetic Acid → HCID 86646540, compound
Reaction equation
[CH3:13][C:14](=[O:15])[OH:16].[Cl:1][c:2]1[n:3][n:4][c:5]([Cl:12])[cH:6][c:7]1[C:8]([F:9])([F:10])[F:11].[NH4+:27].[NH4+:28].[NH4+:29].[OH-:30].[OH2:31].[S:17]([O:18][O:19][S:20]([O-:21])(=[O:22])=[O:23])([O-:24])(=[O:25])=[O:26]>>[Cl:1][c:2]1[n:3][n:4][c:5]([Cl:12])[c:6]([CH3:13])[c:7]1[C:8]([F:9])([F:10])[F:11]Participants
7
Sources & evidence
- ORD record
- ord-b221d744e1034b96a540d7bbbb3cddf6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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