Benzene → alpha-Chloro-5-methyl-2-nitrotoluene
Reaction equation
[CH3:1][c:2]1[cH:3][cH:4][c:5]([N+:10](=[O:11])[O-:12])[c:6]([CH2:7][OH:8])[cH:9]1.[S:13]([Cl:14])([Cl:15])=[O:16].[cH:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([N+:10](=[O:11])[O-:12])[c:6]([CH2:7][Cl:15])[cH:9]1Participants
4
Sources & evidence
- ORD record
- ord-63a703abbacf42a7859ab1fd8afed458
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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