Dichloromethane → HCID 11016069, compound
Reaction equation
[CH3:40][CH2:41][CH2:42][CH2:43][CH2:44][CH3:45].[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[Cl:16][c:17]1[cH:18][c:19]2[c:20]([cH:21][cH:22]1)[n:23][c:24]1[c:25]3[c:26]2[cH:27][c:28]([OH:39])[cH:29][c:30]3[n:31]([CH3:38])[c:32]2[cH:33][cH:34][cH:35][cH:36][c:37]12.[Cl:52][CH2:53][Cl:54].[F:1][C:2]([S:3](=[O:4])(=[O:5])[O:6][S:7]([C:8]([F:9])([F:10])[F:11])(=[O:12])=[O:13])([F:14])[F:15]>>[F:1][C:2]([S:3](=[O:4])(=[O:5])[O:6][c:28]1[cH:27][c:26]2[c:19]3[cH:18][c:17]([Cl:16])[cH:22][cH:21][c:20]3[n:23][c:24]3[c:25]2[c:30]([cH:29]1)[n:31]([CH3:38])[c:32]1[cH:33][cH:34][cH:35][cH:36][c:37]31)([F:14])[F:15]Participants
6
Sources & evidence
- ORD record
- ord-138c510ec6ba443fbf2ce04d5ef37abe
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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