1,2-Dichloroethane → HCID 67607018, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([CH3:8])[CH:9]([CH3:10])[C:11]([NH:12][CH:13]([C:14]([CH3:15])([CH3:16])[CH3:17])[C:18](=[O:19])[N:20]1[CH:21]2[CH:22]([CH2:23][CH2:24]1)[NH:25][CH2:26][CH:27]2[CH2:28][O:29][c:30]1[cH:31][c:32]([F:37])[c:33]([F:36])[cH:34][cH:35]1)=[O:38])=[O:39].[CH2:46]([Cl:47])[CH2:48][Cl:49].[CH3:40][C:41](=[O:42])[C:43]([OH:44])=[O:45].[CH:60]([N:61]([CH2:62][CH3:63])[CH:64]([CH3:65])[CH3:66])([CH3:67])[CH3:68].[Cl:69][CH2:70][Cl:71].[OH:50][n:51]1[c:52]2[c:53]([cH:54][cH:55][cH:56][cH:57]2)[n:58][n:59]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([CH3:8])[CH:9]([CH3:10])[C:11]([NH:12][CH:13]([C:14]([CH3:15])([CH3:16])[CH3:17])[C:18](=[O:19])[N:20]1[CH:21]2[CH:22]([CH2:23][CH2:24]1)[N:25]([C:43]([C:41]([CH3:40])=[O:42])=[O:44])[CH2:26][CH:27]2[CH2:28][O:29][c:30]1[cH:31][c:32]([F:37])[c:33]([F:36])[cH:34][cH:35]1)=[O:38])=[O:39]Participants
7
Sources & evidence
- ORD record
- ord-36b2579fb5834190add72135e316847a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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