1,2-Dichloroethane → HCID 67337611, compound
Reaction equation
[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[cH:6][c:7]([CH:12]=[CH:13][C:14](=[O:15])[OH:16])[cH:8][cH:9][c:10]1[F:11].[CH2:17]([c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1)[n:24]1[n:25][cH:26][c:27]2[cH:28][cH:29][cH:30][c:31]([NH2:33])[c:32]12.[CH2:34]([Cl:35])[CH2:36][Cl:37].[O:48]=[CH:49][N:50]([CH3:51])[CH3:52].[OH2:53].[OH:38][n:39]1[c:40]2[c:41]([cH:42][cH:43][cH:44][cH:45]2)[n:46][n:47]1>>[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[cH:6][c:7]([CH:12]=[CH:13][C:14](=[O:16])[NH:33][c:31]2[cH:30][cH:29][cH:28][c:27]3[cH:26][n:25][n:24]([CH2:17][c:18]4[cH:19][cH:20][cH:21][cH:22][cH:23]4)[c:32]32)[cH:8][cH:9][c:10]1[F:11]Participants
7
Sources & evidence
- ORD record
- ord-7b18cff64c3d4c0fbd7a7dbb0aafc4bf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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