1,4-Dioxane → HCID 58964518, compound
Reaction equation
[CH3:12][O:13][C:14]([c:15]1[c:16]([NH2:30])[cH:17][c:18]([C:26]([F:27])([F:28])[F:29])[c:19]([N:21]([CH3:22])[C:23]([CH3:24])=[O:25])[cH:20]1)=[O:31].[Cl:1][C:2](=[O:3])[O:4][c:5]1[cH:6][cH:7][c:8]([Cl:11])[cH:9][cH:10]1.[O:32]1[CH2:33][CH2:34][O:35][CH2:36][CH2:37]1>>[C:2](=[O:3])([O:4][c:5]1[cH:6][cH:7][c:8]([Cl:11])[cH:9][cH:10]1)[NH:30][c:16]1[c:15]([C:14]([O:13][CH3:12])=[O:31])[cH:20][c:19]([N:21]([CH3:22])[C:23]([CH3:24])=[O:25])[c:18]([C:26]([F:27])([F:28])[F:29])[cH:17]1Participants
4
Sources & evidence
- ORD record
- ord-ee825555784a487080bfb950aba020a4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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