1,2-Dichloroethane → HCID 66691716, compound
Reaction equation
[CH2:35]([Cl:36])[CH2:37][Cl:38].[CH3:1][O:2][c:3]1[c:4](-[c:9]2[n:10][o:11][c:12]([CH3:17])[c:13]2[C:14](=[O:15])[OH:16])[cH:5][cH:6][cH:7][cH:8]1.[CH3:39][N:40]([CH3:41])[c:42]1[cH:43][cH:44][n:45][cH:46][cH:47]1.[Cl:18][c:19]1[cH:20][c:21]([N+:32](=[O:33])[O-:34])[c:22]([NH2:23])[cH:24][c:25]1[N:26]1[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]1.[Cl:48][CH2:49][Cl:50]>>[CH3:1][O:2][c:3]1[c:4](-[c:9]2[n:10][o:11][c:12]([CH3:17])[c:13]2[C:14](=[O:16])[N:29]2[CH2:28][CH2:27][N:26]([c:25]3[c:19]([Cl:18])[cH:20][c:21]([N+:32](=[O:33])[O-:34])[c:22]([NH2:23])[cH:24]3)[CH2:31][CH2:30]2)[cH:5][cH:6][cH:7][cH:8]1Participants
6
Sources & evidence
- ORD record
- ord-0769b41f464249618c2949a199cd2eaf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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