2-Chloroethanol → HCID 18687665, compound
Reaction equation
[CH3:12][O:13][c:14]1[cH:15][c:16]([S:17][CH3:18])[c:19]([F:20])[cH:21][c:22]1[OH:23].[CH3:1][O:2][c:3]1[c:4]([OH:11])[cH:5][c:6]([F:10])[c:7]([F:9])[cH:8]1.[O:47]=[C:48]([O:49][CH2:50][CH3:51])[N:52]=[N:53][C:54]([O:55][CH2:56][CH3:57])=[O:58].[O:59]1[CH2:60][CH2:61][CH2:62][CH2:63]1.[OH:43][CH2:44][CH2:45][Cl:46].[c:24]1([P:25]([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[CH3:1][O:2][c:3]1[c:4]([O:43][CH2:44][CH2:45][Cl:46])[cH:5][c:6]([F:10])[c:7]([F:9])[cH:8]1Participants
7
Sources & evidence
- ORD record
- ord-b8ccad6de04a4c61bf7fec6101015600
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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