1,2-Dichloroethane → HCID 76725647, compound
Reaction equation
[CH2:53]([Cl:54])[CH2:55][Cl:56].[CH2:64]([Cl:65])[Cl:66].[CH3:24][O:25][C:26](=[O:27])[c:28]1[c:29](-[c:34]2[cH:35][c:36]([C:40](=[O:41])[OH:42])[cH:37][cH:38][cH:39]2)[cH:30][cH:31][cH:32][cH:33]1.[CH3:57][CH2:58][N:59]([CH2:60][CH3:61])[CH2:62][CH3:63].[NH2:1][CH:2]([C:3](=[O:4])[N:5]1[CH2:6][C:7]([CH3:19])([CH3:20])[C:8]([OH:11])([c:12]2[cH:13][cH:14][c:15]([Cl:18])[cH:16][cH:17]2)[CH2:9][CH2:10]1)[CH:21]([CH3:22])[CH3:23].[OH:43][n:44]1[c:45]2[c:46]([cH:47][cH:48][cH:49][cH:50]2)[n:51][n:52]1>>[NH:1]([CH:2]([C:3](=[O:4])[N:5]1[CH2:6][C:7]([CH3:19])([CH3:20])[C:8]([OH:11])([c:12]2[cH:13][cH:14][c:15]([Cl:18])[cH:16][cH:17]2)[CH2:9][CH2:10]1)[CH:21]([CH3:22])[CH3:23])[C:40]([c:36]1[cH:35][c:34](-[c:29]2[c:28]([C:26]([O:25][CH3:24])=[O:27])[cH:33][cH:32][cH:31][cH:30]2)[cH:39][cH:38][cH:37]1)=[O:41]Participants
7
Sources & evidence
- ORD record
- ord-f51d5989589e4e5fab07f5491083ae0a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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