1,2-Dichloroethane → HCID 136057256, compound
Reaction equation
[Cl:47][CH2:48][CH2:49][Cl:50].[ClH:1].[F:4][C:5]([c:6]1[cH:7][c:8]([CH2:9][n:10]2[n:11][n:12][c:13](-[c:21]3[n:22]([CH2:28][c:29]4[c:30]([Cl:35])[cH:31][cH:32][cH:33][cH:34]4)[c:23]([CH:26]=[O:27])[n:24][n:25]3)[c:14]2-[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[cH:36][c:37]([C:39]([F:40])([F:41])[F:42])[cH:38]1)([F:43])[F:44].[NH2:2][OH:3].[Na+:46].[OH-:45]>>[N:2]([OH:3])=[CH:26][c:23]1[n:22]([CH2:28][c:29]2[c:30]([Cl:35])[cH:31][cH:32][cH:33][cH:34]2)[c:21](-[c:13]2[n:12][n:11][n:10]([CH2:9][c:8]3[cH:7][c:6]([C:5]([F:4])([F:43])[F:44])[cH:38][c:37]([C:39]([F:40])([F:41])[F:42])[cH:36]3)[c:14]2-[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[n:25][n:24]1Participants
7
Sources & evidence
- ORD record
- ord-87c56986247c44149916fbcbcfa3723a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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