1,2-Dichloroethane → HCID 69510346, compound
Reaction equation
[CH2:52]([Cl:53])[CH2:54][Cl:55].[CH3:13][C:14]([CH3:15])([CH:16]1[CH2:17][CH2:18][N:19]([CH3:22])[CH2:20][CH2:21]1)[c:23]1[cH:24][cH:25][c:26]([NH2:29])[cH:27][cH:28]1.[CH:30]([N:31]([CH2:32][CH3:33])[CH:34]([CH3:35])[CH3:36])([CH3:37])[CH3:38].[Cl:49][CH2:50][Cl:51].[OH:1][C:2](=[O:3])[c:4]1[cH:5][cH:6][cH:7][cH:8][c:9]1[N+:10]([O-:11])=[O:12].[OH:39][n:40]1[c:41]2[c:42]([cH:43][cH:44][cH:45][cH:46]2)[n:47][n:48]1>>[C:2](=[O:3])([c:4]1[cH:5][cH:6][cH:7][cH:8][c:9]1[N+:10]([O-:11])=[O:12])[NH:29][c:26]1[cH:25][cH:24][c:23]([C:14]([CH3:13])([CH3:15])[CH:16]2[CH2:17][CH2:18][N:19]([CH3:22])[CH2:20][CH2:21]2)[cH:28][cH:27]1Participants
7
Sources & evidence
- ORD record
- ord-d863ceecdc41425c820069cb0d8c098d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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