1,2-Dichloroethane → HCID 76649521, compound
Reaction equation
[CH2:18]([Cl:19])[CH2:20][Cl:21].[CH3:1][O:2][P:3](=[O:4])([O:5][CH3:6])[c:7]1[cH:8][c:9]([CH:13]=[CH:14][C:15](=[O:16])[OH:17])[cH:10][cH:11][cH:12]1.[NH2:32][c:33]1[c:34]([NH:44][C:45]([O:46][C:47]([CH3:48])([CH3:49])[CH3:50])=[O:51])[cH:35][cH:36][c:37](-[c:39]2[s:40][cH:41][cH:42][cH:43]2)[cH:38]1.[O:52]=[CH:53][N:54]([CH3:55])[CH3:56].[OH:22][n:23]1[c:24]2[c:25]([cH:26][cH:27][cH:28][cH:29]2)[n:30][n:31]1>>[CH3:1][O:2][P:3](=[O:4])([O:5][CH3:6])[c:7]1[cH:8][c:9]([CH:13]=[CH:14][C:15](=[O:17])[NH:32][c:33]2[c:34]([NH:44][C:45]([O:46][C:47]([CH3:48])([CH3:49])[CH3:50])=[O:51])[cH:35][cH:36][c:37](-[c:39]3[s:40][cH:41][cH:42][cH:43]3)[cH:38]2)[cH:10][cH:11][cH:12]1Participants
6
Sources & evidence
- ORD record
- ord-6348f49a7d804c18950f22d80ad79b55
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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