4-(Bromomethyl)-3-fluorobenzonitrile → HCID 67050099, compound
Reaction equation
[Br:26][CH2:27][c:28]1[c:29]([F:36])[cH:30][c:31]([C:32]#[N:33])[cH:34][cH:35]1.[CH:1]1([CH2:7][n:8]2[c:9](-[c:19]3[c:20]([OH:25])[cH:21][cH:22][cH:23][cH:24]3)[n:10][c:11]3[c:12]2[cH:13][c:14]([F:18])[c:15]([F:17])[cH:16]3)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1>>[CH:1]1([CH2:7][n:8]2[c:9](-[c:19]3[c:20]([O:25][CH2:27][c:28]4[c:29]([F:36])[cH:30][c:31]([C:32]#[N:33])[cH:34][cH:35]4)[cH:21][cH:22][cH:23][cH:24]3)[n:10][c:11]3[c:12]2[cH:13][c:14]([F:18])[c:15]([F:17])[cH:16]3)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1Participants
3
Sources & evidence
- ORD record
- ord-912f8bb0acbb43e192a8041a25085ed7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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