1,2-Dichloroethane → HCID 178459083, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[c:9]([CH3:23])[c:10]([CH2:19][C:20](=[O:21])[OH:22])[c:11]2[cH:12][c:13]([O:17][CH3:18])[cH:14][cH:15][c:16]12.[CH2:24]([Cl:25])[CH2:26][Cl:27].[CH:39]([N:40]([CH2:41][CH3:42])[CH:43]([CH3:44])[CH3:45])([CH3:46])[CH3:47].[ClH:28].[NH2:48][CH:49]([CH2:50][CH2:51][CH2:52][CH2:53][CH2:54][C:55]([CH2:56][CH3:57])=[O:58])[c:59]1[n:60]([CH2:65][O:66][CH2:67][CH2:68][Si:69]([CH3:70])([CH3:71])[CH3:72])[cH:61][c:62]([Br:64])[n:63]1.[O:73]=[CH:74][N:75]([CH3:76])[CH3:77].[OH:29][n:30]1[c:31]2[c:32]([cH:33][cH:34][cH:35][cH:36]2)[n:37][n:38]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[c:9]([CH3:23])[c:10]([CH2:19][C:20](=[O:21])[NH:48][CH:49]([CH2:50][CH2:51][CH2:52][CH2:53][CH2:54][C:55]([CH2:56][CH3:57])=[O:58])[c:59]2[n:60]([CH2:65][O:66][CH2:67][CH2:68][Si:69]([CH3:70])([CH3:71])[CH3:72])[cH:61][c:62]([Br:64])[n:63]2)[c:11]2[cH:12][c:13]([O:17][CH3:18])[cH:14][cH:15][c:16]12Participants
8
Sources & evidence
- ORD record
- ord-affbf7e274ab4ebe8385f09880c1edfe
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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