1,2-Dichloroethane → HCID 11526678, compound
Reaction equation
[CH2:41]([Cl:42])[CH2:43][Cl:44].[CH3:45][N:46]([CH2:47][CH2:48][CH2:49][NH2:50])[CH3:51].[NH2:1][c:2]1[c:3]([O:19][CH:20]([CH3:21])[c:22]2[c:23]([Cl:30])[c:24]([F:29])[cH:25][cH:26][c:27]2[Cl:28])[cH:4][c:5](-[c:8]2[cH:9][n:10][n:11]([C:13]([C:14](=[O:15])[OH:16])([CH3:17])[CH3:18])[cH:12]2)[cH:6][n:7]1.[O:52]=[CH:53][N:54]([CH3:55])[CH3:56].[OH:31][n:32]1[c:33]2[c:34]([cH:35][cH:36][cH:37][cH:38]2)[n:39][n:40]1>>[NH2:1][c:2]1[c:3]([O:19][CH:20]([CH3:21])[c:22]2[c:23]([Cl:30])[c:24]([F:29])[cH:25][cH:26][c:27]2[Cl:28])[cH:4][c:5](-[c:8]2[cH:9][n:10][n:11]([C:13]([C:14](=[O:15])[NH:50][CH2:49][CH2:48][CH2:47][N:46]([CH3:45])[CH3:51])([CH3:17])[CH3:18])[cH:12]2)[cH:6][n:7]1Participants
6
Sources & evidence
- ORD record
- ord-85b1fead18bb4be5a3496573b7e08428
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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