Acetic Acid → HCID 54707409, compound
Reaction equation
[CH3:1][C:2](=[O:3])[OH:4].[CH3:41][CH2:42][OH:43].[Cl:33][c:34]1[cH:35][cH:36][c:37]([SH:40])[cH:38][cH:39]1.[F:11][c:12]1[c:13]([CH:14]=[O:15])[cH:16][c:17]([F:20])[cH:18][cH:19]1.[OH:21][c:22]1[cH:23][c:24](=[O:32])[o:25][c:26]2[cH:27][cH:28][cH:29][cH:30][c:31]12.[cH:5]1[cH:6][cH:7][n:8][cH:9][cH:10]1>>[F:11][c:12]1[c:13]([CH:14]([c:23]2[c:22]([OH:21])[c:31]3[c:26]([o:25][c:24]2=[O:32])[cH:27][cH:28][cH:29][cH:30]3)[S:40][c:37]2[cH:36][cH:35][c:34]([Cl:33])[cH:39][cH:38]2)[cH:16][c:17]([F:20])[cH:18][cH:19]1Participants
7
Sources & evidence
- ORD record
- ord-d794c1058fe243d6af8a2bfe60d0b9a7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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