1,2-Dichloroethane → HCID 53889813, compound
Reaction equation
[CH2:61]([Cl:62])[CH2:63][Cl:64].[CH3:45][N:46]([CH2:47][CH2:48][NH2:49])[CH3:50].[CH:65]([N:66]([CH2:67][CH3:68])[CH:69]([CH3:70])[CH3:71])([CH3:72])[CH3:73].[Cl:1][c:2]1[cH:3][c:4]([C:9]2([CH2:28][CH2:29][N:30]3[CH2:31][CH2:32][C:33]([C:36](=[O:37])[OH:38])([c:39]4[cH:40][cH:41][cH:42][cH:43][cH:44]4)[CH2:34][CH2:35]3)[CH2:10][N:11]([C:14]([c:15]3[cH:16][c:17]([O:25][CH3:26])[c:18]([O:23][CH3:24])[c:19]([O:21][CH3:22])[cH:20]3)=[O:27])[CH2:12][CH2:13]2)[cH:5][cH:6][c:7]1[Cl:8].[Cl:74][CH2:75][Cl:76].[OH:51][n:52]1[c:53]2[c:54]([cH:55][cH:56][cH:57][cH:58]2)[n:59][n:60]1>>[Cl:1][c:2]1[cH:3][c:4]([C:9]2([CH2:28][CH2:29][N:30]3[CH2:31][CH2:32][C:33]([C:36](=[O:37])[NH:49][CH2:48][CH2:47][N:46]([CH3:45])[CH3:50])([c:39]4[cH:40][cH:41][cH:42][cH:43][cH:44]4)[CH2:34][CH2:35]3)[CH2:10][N:11]([C:14]([c:15]3[cH:16][c:17]([O:25][CH3:26])[c:18]([O:23][CH3:24])[c:19]([O:21][CH3:22])[cH:20]3)=[O:27])[CH2:12][CH2:13]2)[cH:5][cH:6][c:7]1[Cl:8]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-60197bae76e54117928acdb27dab99cb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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