Benzene → HCID 54729787, compound
Reaction equation
[CH3:21][CH2:22][CH2:23][CH2:24][CH2:25][CH3:26].[ClH:20].[F:11][c:12]1[c:13]([CH2:14][Cl:15])[cH:16][cH:17][cH:18][cH:19]1.[OH:1][c:2]1[c:3]([SH:10])[c:4](=[O:9])[o:5][c:6]([CH3:8])[cH:7]1.[cH:27]1[cH:28][cH:29][n:30][cH:31][cH:32]1.[cH:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1>>[OH:1][c:2]1[c:3]([S:10][CH2:14][c:13]2[c:12]([F:11])[cH:19][cH:18][cH:17][cH:16]2)[c:4](=[O:9])[o:5][c:6]([CH3:8])[cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-1ebfe555a8f645eb80bac35e2cc4a74a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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