Ethanol → 6-Methyl-2,4-bis(trichloromethyl)-2H,4H-1,3-benzodioxine
Reaction equation
[CH3:25][CH2:26][OH:27].[CH3:33][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1.[N:1]([O-:2])=[O:3].[NH2:5][c:6]1[cH:7][c:8]([CH3:24])[cH:9][c:10]2[c:15]1[O:14][CH:13]([C:16]([Cl:17])([Cl:18])[Cl:19])[O:12][CH:11]2[C:20]([Cl:21])([Cl:22])[Cl:23].[Na+:4].[S:28](=[O:29])(=[O:30])([OH:31])[OH:32]>>[cH:6]1[cH:7][c:8]([CH3:24])[cH:9][c:10]2[c:15]1[O:14][CH:13]([C:16]([Cl:17])([Cl:18])[Cl:19])[O:12][CH:11]2[C:20]([Cl:21])([Cl:22])[Cl:23]Participants
7
Sources & evidence
- ORD record
- ord-049710ece0b2480b9bebaf9f050dc938
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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