1,2-Dichloroethane → HCID 178502229, compound
Reaction equation
[CH2:13]([Cl:14])[CH2:15][Cl:16].[CH3:1][O:2][C:3](=[O:4])[NH:5][CH:6]([CH:7]([CH3:8])[CH3:9])[C:10](=[O:11])[OH:12].[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[CH3:34][N:35]1[CH2:36][CH2:37][N:38]([c:41]2[cH:42][cH:43][c:44]([CH2:47][N:48]([CH2:49][CH:50]([CH:51]([CH2:52][c:53]3[cH:54][cH:55][cH:56][cH:57][cH:58]3)[NH2:59])[OH:60])[NH:61][C:62](=[O:63])[O:64][C:65]([CH3:66])([CH3:67])[CH3:68])[cH:45][cH:46]2)[CH2:39][CH2:40]1.[O:69]=[CH:70][N:71]([CH3:72])[CH3:73].[OH:17][n:18]1[c:19]2[c:20]([cH:21][cH:22][cH:23][cH:24]2)[n:25][n:26]1>>[CH3:1][O:2][C:3](=[O:4])[NH:5][CH:6]([CH:7]([CH3:8])[CH3:9])[C:10](=[O:12])[NH:59][CH:51]([CH:50]([CH2:49][N:48]([CH2:47][c:44]1[cH:43][cH:42][c:41]([N:38]2[CH2:37][CH2:36][N:35]([CH3:34])[CH2:40][CH2:39]2)[cH:46][cH:45]1)[NH:61][C:62](=[O:63])[O:64][C:65]([CH3:66])([CH3:67])[CH3:68])[OH:60])[CH2:52][c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1Participants
7
Sources & evidence
- ORD record
- ord-f62515c6d4ea43229877b3b7d1bd8eac
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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