1,2-Dichloroethane → HCID 58011813, compound
Reaction equation
[CH2:49]([Cl:50])[CH2:51][Cl:52].[CH3:58][CH2:59][O:60][C:61](=[O:62])[CH3:63].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:7]2[n:8][n:9]([CH2:21][C:22](=[O:23])[OH:24])[c:10](=[O:20])[n:11]2[CH2:12][c:13]2[c:14]([F:19])[cH:15][cH:16][cH:17][cH:18]2)[s:6]1.[F:25][C:26]([c:27]1[cH:28][c:29]([C:33]([CH3:34])([CH3:35])[NH2:36])[cH:30][cH:31][cH:32]1)([F:37])[F:38].[O:53]=[CH:54][N:55]([CH3:56])[CH3:57].[OH2:64].[OH:39][n:40]1[c:41]2[c:42]([cH:43][cH:44][cH:45][cH:46]2)[n:47][n:48]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:7]2[n:8][n:9]([CH2:21][C:22](=[O:24])[NH:36][C:33]([c:29]3[cH:28][c:27]([C:26]([F:25])([F:37])[F:38])[cH:32][cH:31][cH:30]3)([CH3:34])[CH3:35])[c:10](=[O:20])[n:11]2[CH2:12][c:13]2[c:14]([F:19])[cH:15][cH:16][cH:17][cH:18]2)[s:6]1Participants
8
Sources & evidence
- ORD record
- ord-0e714569eebf473e8e0a2ee87e89f409
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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