1-(Chloromethyl)-2-(trifluoromethyl)benzene → HCID 11407855, compound
Reaction equation
[CH:1]1([CH2:4][CH2:5][NH:6][C:7](=[O:8])[c:9]2[n:10][n:11][c:12]([N:15]3[CH2:16][CH2:17][NH:18][CH2:19][CH2:20]3)[cH:13][cH:14]2)[CH2:2][CH2:3]1.[F:21][C:22]([c:23]1[c:24]([CH2:25][Cl:26])[cH:27][cH:28][cH:29][cH:30]1)([F:31])[F:32]>>[CH:1]1([CH2:4][CH2:5][NH:6][C:7](=[O:8])[c:9]2[n:10][n:11][c:12]([N:15]3[CH2:16][CH2:17][N:18]([CH2:25][c:24]4[c:23]([C:22]([F:21])([F:31])[F:32])[cH:30][cH:29][cH:28][cH:27]4)[CH2:19][CH2:20]3)[cH:13][cH:14]2)[CH2:2][CH2:3]1Participants
3
Sources & evidence
- ORD record
- ord-dbf2230efbec40cdbf69349b17c772c3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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