Benzoic Acid → 2-(2-Fluorophenyl)-6-nitro-1,3-benzodioxan
Reaction equation
[CH3:31][CH2:32][O:33][C:34](=[O:35])[CH3:36].[F:13][c:14]1[c:15]([CH:16]=[O:17])[cH:18][cH:19][cH:20][cH:21]1.[OH:1][c:2]1[c:3]([CH2:4][OH:5])[cH:6][c:7]([N+:10](=[O:11])[O-:12])[cH:8][cH:9]1.[OH:22][C:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)=[O:30]>>[O:1]1[c:2]2[c:3]([cH:6][c:7]([N+:10](=[O:11])[O-:12])[cH:8][cH:9]2)[CH2:4][O:5][CH:16]1[c:15]1[c:14]([F:13])[cH:21][cH:20][cH:19][cH:18]1Participants
5
Sources & evidence
- ORD record
- ord-770f8930338b447a88450368576892d2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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