Carbon Tetrachloride → 3-{[3-(Bromomethyl)-6-chloro-2-fluorophenyl]oxy}-5-(trifluoromethyl)benzonitrile
Reaction equation
[Br:23][N:24]1[C:25](=[O:26])[CH2:27][CH2:28][C:29]1=[O:30].[C:43]([Cl:44])([Cl:45])([Cl:46])[Cl:47].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH3:22])[c:6]([F:21])[c:7]1[O:8][c:9]1[cH:10][c:11]([C:12]#[N:13])[cH:14][c:15]([C:17]([F:18])([F:19])[F:20])[cH:16]1.[N:31]#[C:32][C:33]([N:34]=[N:35][C:36]([C:37]#[N:38])([CH3:39])[CH3:40])([CH3:41])[CH3:42]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:22][Br:23])[c:6]([F:21])[c:7]1[O:8][c:9]1[cH:10][c:11]([C:12]#[N:13])[cH:14][c:15]([C:17]([F:18])([F:19])[F:20])[cH:16]1Participants
5
Sources & evidence
- ORD record
- ord-6e401d160bc742b48a0f672bb9c1524c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
Loading…