1,2-Dichloroethane → HCID 178452357, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][CH:9]1[CH:10]([n:15]2[c:16](=[O:29])[nH:17][c:18]([C:26](=[O:27])[OH:28])[c:19]2-[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[CH2:11][CH2:12][CH2:13][CH2:14]1.[CH2:30]([Cl:31])[CH2:32][Cl:33].[CH:44]([N:45]([CH2:46][CH3:47])[CH:48]([CH3:49])[CH3:50])([CH3:51])[CH3:52].[N:53]1([C:59](=[O:60])[O:61][C:62]([CH3:63])([CH3:64])[CH3:65])[CH2:54][CH2:55][NH:56][CH2:57][CH2:58]1.[O:66]=[CH:67][N:68]([CH3:69])[CH3:70].[OH2:71].[OH:34][n:35]1[c:36]2[c:37]([cH:38][cH:39][cH:40][cH:41]2)[n:42][n:43]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][CH:9]1[CH:10]([n:15]2[c:16](=[O:29])[nH:17][c:18]([C:26](=[O:27])[N:56]3[CH2:55][CH2:54][N:53]([C:59](=[O:60])[O:61][C:62]([CH3:63])([CH3:64])[CH3:65])[CH2:58][CH2:57]3)[c:19]2-[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[CH2:11][CH2:12][CH2:13][CH2:14]1Participants
8
Sources & evidence
- ORD record
- ord-e6ce31ba08ee45d99b0a058fb41ef368
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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