1,2-Dichloroethane → HCID 69307880, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[N:11]1[CH2:12][CH:13]([OH:27])[CH:14]([NH:18][C:19]([CH:20]([CH2:21][CH:22]([CH3:23])[CH3:24])[NH2:25])=[O:26])[CH2:15][CH2:16][CH2:17]1.[CH2:28]([Cl:29])[CH2:30][Cl:31].[CH3:57][OH:58].[Cl:54][CH2:55][Cl:56].[OH:32][n:33]1[c:34]2[c:35]([cH:36][cH:37][cH:38][cH:39]2)[n:40][n:41]1.[o:42]1[c:43]([C:51](=[O:52])[OH:53])[cH:44][c:45]2[c:46]1[cH:47][cH:48][cH:49][cH:50]2>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[N:11]1[CH2:12][CH:13]([OH:27])[CH:14]([NH:18][C:19]([CH:20]([CH2:21][CH:22]([CH3:23])[CH3:24])[NH:25][C:51]([c:43]2[o:42][c:46]3[c:45]([cH:44]2)[cH:50][cH:49][cH:48][cH:47]3)=[O:52])=[O:26])[CH2:15][CH2:16][CH2:17]1Participants
7
Sources & evidence
- ORD record
- ord-4ed78f00a1204d71b97376f63e5caf03
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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