1,2-Dichlorobenzene → HCID 57756581, compound
Reaction equation
[CH3:35][N:36]([CH3:37])[c:38]1[cH:39][cH:40][n:41][cH:42][cH:43]1.[Cl:16][c:17]1[cH:18][c:19]([NH:20][C:21]([c:22]2[c:23]([OH:24])[cH:25][cH:26][c:27]([Cl:29])[cH:28]2)=[O:30])[cH:31][cH:32][c:33]1[Cl:34].[Cl:1][c:2]1[cH:3][cH:4][n:5][c:6]2[cH:7][c:8]([O:14][CH3:15])[c:9]([O:12][CH3:13])[cH:10][c:11]12.[Cl:44][c:45]1[cH:46][cH:47][cH:48][cH:49][c:50]1[Cl:51]>>[c:2]1([O:24][c:23]2[c:22]([C:21]([NH:20][c:19]3[cH:18][c:17]([Cl:16])[c:33]([Cl:34])[cH:32][cH:31]3)=[O:30])[cH:28][c:27]([Cl:29])[cH:26][cH:25]2)[cH:3][cH:4][n:5][c:6]2[cH:7][c:8]([O:14][CH3:15])[c:9]([O:12][CH3:13])[cH:10][c:11]12Participants
5
Sources & evidence
- ORD record
- ord-456cc977e09648a3a7bbd4212d36a6b6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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