Acetic Acid → HCID 22440998, compound
Reaction equation
[CH3:30][C:31](=[O:32])[OH:33].[Cl:1][c:2]1[c:3]([F:28])[c:4]([F:27])[cH:5][c:6]2[c:7](=[O:26])[c:8]([C:21](=[O:22])[O:23][CH2:24][CH3:25])[cH:9][n:10](-[c:12]3[c:13]([F:20])[cH:14][c:15]([F:19])[cH:16][c:17]3[F:18])[c:11]12.[ClH:29]>>[Cl:1][c:2]1[c:3]([F:28])[c:4]([F:27])[cH:5][c:6]2[c:7](=[O:26])[c:8]([C:21](=[O:22])[OH:23])[cH:9][n:10](-[c:12]3[c:13]([F:20])[cH:14][c:15]([F:19])[cH:16][c:17]3[F:18])[c:11]12Participants
4
Sources & evidence
- ORD record
- ord-67caa2f456b141ebad010d2dd4f63c71
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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