Acetic Acid → HCID 22614854, compound
Reaction equation
[CH2:39]1[O:40][CH2:41][CH2:42][O:43][CH2:44]1.[CH3:35][C:36](=[O:37])[OH:38].[Cl:3][c:4]1[c:5](-[n:19]2[c:20]([C:30]([O:31][CH2:32][CH3:33])=[O:34])[n:21][n:22][c:23]2-[c:24]2[cH:25][n:26][cH:27][cH:28][cH:29]2)[c:6]2[n:7][c:8]([O:17][CH3:18])[c:9]([O:15][CH3:16])[n:10][c:11]2[cH:12][c:13]1[Cl:14].[Na+:2].[OH-:1].[OH2:45]>>[Cl:3][c:4]1[c:5](-[n:19]2[cH:20][n:21][n:22][c:23]2-[c:24]2[cH:25][n:26][cH:27][cH:28][cH:29]2)[c:6]2[n:7][c:8]([O:17][CH3:18])[c:9]([O:15][CH3:16])[n:10][c:11]2[cH:12][c:13]1[Cl:14]Participants
7
Sources & evidence
- ORD record
- ord-607274bfe9284719b42c8511a5d398e1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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