1,2,3-Trifluorobenzene → HCID 11375606, compound
Reaction equation
[BH:37]([OH:38])[OH:39].[CH3:1][O:2][c:3]1[cH:4][c:5]2[cH:6][cH:7][c:8]([O:29][S:30]([C:31]([F:32])([F:33])[F:34])(=[O:35])=[O:36])[c:9]([O:13][c:14]3[cH:15][cH:16][c:17]([O:20][CH2:21][CH2:22][N:23]4[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]4)[cH:18][cH:19]3)[c:10]2[cH:11][cH:12]1.[CH:51]1([P:52]([CH:53]2[CH2:54][CH2:55][CH2:56][CH2:57][CH2:58]2)[CH:59]2[CH2:60][CH2:61][CH2:62][CH2:63][CH2:64]2)[CH2:65][CH2:66][CH2:67][CH2:68][CH2:69]1.[Cs+:50].[F-:49].[F:40][c:41]1[cH:42][cH:43][cH:44][c:45]([F:48])[c:46]1[F:47]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[cH:6][cH:7][c:8](-[c:43]3[cH:42][c:41]([F:40])[c:46]([F:47])[c:45]([F:48])[cH:44]3)[c:9]([O:13][c:14]3[cH:15][cH:16][c:17]([O:20][CH2:21][CH2:22][N:23]4[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]4)[cH:18][cH:19]3)[c:10]2[cH:11][cH:12]1Participants
7
Sources & evidence
- ORD record
- ord-207d90ed05ca488c8bd28c4509d19e08
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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