1,2-Dichloroethane → HCID 66627995, compound
Reaction equation
[C:17]([CH3:18])([CH3:19])([CH3:20])[O:21][C:22]([NH:23][CH:24]1[CH2:25][CH2:26][CH:27]([CH2:30][CH:31]=[O:32])[CH2:28][CH2:29]1)=[O:33].[C:34]([O:35][C:36](=[O:37])[NH:38][CH:39]1[CH2:40][CH2:41][CH:42]([CH2:43][CH2:44][N:45]2[CH2:46][CH2:47][CH:48]([C:49](=[O:50])[c:51]3[cH:52][cH:53][c:54]([F:55])[cH:56][cH:57]3)[CH2:58][CH2:59]2)[CH2:60][CH2:61]1)([CH3:62])([CH3:63])[CH3:64].[C:65]([O:66][BH-:67]([O:68][C:69](=[O:70])[CH3:71])[O:72][C:73](=[O:74])[CH3:75])(=[O:76])[CH3:77].[Cl:78][CH2:79][CH2:80][Cl:81].[F:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[O:9])[C:10]2([OH:16])[CH2:11][CH2:12][NH:13][CH2:14][CH2:15]2)[cH:6][cH:7]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[O:9])[C:10]2([OH:16])[CH2:11][CH2:12][N:13]([CH2:31][CH2:30][CH:27]3[CH2:26][CH2:25][CH:24]([NH:23][C:22]([O:21][C:17]([CH3:18])([CH3:19])[CH3:20])=[O:33])[CH2:29][CH2:28]3)[CH2:14][CH2:15]2)[cH:6][cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-3f5a2de0209b478582233833167ad076
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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