Benzene → HCID 20348735, compound
Reaction equation
[BH4-:47].[CH3:65][OH:66].[F:17][c:18]1[cH:19][cH:20][cH:21][cH:22][c:23]1-[c:24]1[cH:25][cH:26][c:27]([CH2:28][C:29]([CH2:30][c:31]2[cH:32][cH:33][c:34](-[c:35]3[cH:36][cH:37][cH:38][cH:39][c:40]3[F:41])[cH:42][cH:43]2)=[O:44])[cH:45][cH:46]1.[F:1][c:2]1[c:3](-[c:8]2[cH:9][cH:10][c:11]([CH:14]([CH3:15])[OH:16])[cH:12][cH:13]2)[cH:4][cH:5][cH:6][cH:7]1.[Na+:48].[SH:49][CH2:50][C:51](=[O:52])[OH:53].[c:54]1([CH3:55])[cH:56][cH:57][c:58]([S:59]([OH:60])(=[O:61])=[O:62])[cH:63][cH:64]1.[cH:67]1[cH:68][cH:69][cH:70][cH:71][cH:72]1>>[F:1][c:2]1[c:3](-[c:8]2[cH:9][cH:10][c:11]([CH:14]([CH3:15])[S:49][CH2:50][C:51](=[O:52])[OH:53])[cH:12][cH:13]2)[cH:4][cH:5][cH:6][cH:7]1Participants
9
Sources & evidence
- ORD record
- ord-1b9c7043920b4a62be6817098d4058e2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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