Bromide ion → 1-[1-[3-(Bromomethyl)-2-(4-fluorophenyl)cyclopentyl]oxyethyl]-3,5-bis(trifluoromethyl)benzene
Reaction equation
[Br-:32].[Br-:33].[CH3:53][C:54]#[N:55].[F:1][C:2]([c:3]1[cH:4][c:5]([CH:13]([CH3:14])[O:15][CH:16]2[CH:17]([c:23]3[cH:24][cH:25][c:26]([F:29])[cH:27][cH:28]3)[CH:18]([CH2:21][OH:22])[CH2:19][CH2:20]2)[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:30])[F:31].[c:34]1([P:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:48][cH:49][cH:50][cH:51][cH:52]1>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH:13]([CH3:14])[O:15][CH:16]2[CH:17]([c:23]3[cH:24][cH:25][c:26]([F:29])[cH:27][cH:28]3)[CH:18]([CH2:21][Br:32])[CH2:19][CH2:20]2)[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:30])[F:31]Participants
5
Sources & evidence
- ORD record
- ord-1e0b01d8d8bd47be82f3816837d21cac
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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