Carbon Tetrachloride → 5-(4-bromomethyl-3-chlorophenyl) 3-(2-chloro-6-fluorophenyl)-1-methyl-1H-1,2,4-triazole

HRID 315903Notes

Reaction equation

HRID 315903 reaction equation
[Br:23][N:24]=[C:25]([OH:26])[CH2:27][CH2:28][C:29]([OH:30])=[O:31].[C:44]([Cl:45])([Cl:46])([Cl:47])[Cl:48].[Cl:1][c:2]1[c:3](-[c:9]2[n:10][n:11]([CH3:22])[c:12](-[c:14]3[cH:15][c:16]([Cl:21])[c:17]([CH3:20])[cH:18][cH:19]3)[n:13]2)[c:4]([F:8])[cH:5][cH:6][cH:7]1.[N:32]#[C:33][C:34]([N:35]=[N:36][C:37]([C:38]#[N:39])([CH3:40])[CH3:41])([CH3:42])[CH3:43]>>[Cl:1][c:2]1[c:3](-[c:9]2[n:10][n:11]([CH3:22])[c:12](-[c:14]3[cH:15][c:16]([Cl:21])[c:17]([CH2:20][Br:23])[cH:18][cH:19]3)[n:13]2)[c:4]([F:8])[cH:5][cH:6][cH:7]1

Participants

5

Reactant 4

HCID 5943Carbon TetrachlorideHCID 6547AzobisisobutyronitrileHCID 214636473-(2-chloro-6-fluorophenyl)-5-(3-chloro-4-methylphenyl) 1-methyl-1H-1,2,4-triazoleHCID 178525505HCID 178525505, compound

Product 1

HCID 214636485-(4-bromomethyl-3-chlorophenyl) 3-(2-chloro-6-fluorophenyl)-1-methyl-1H-1,2,4-triazole

Sources & evidence

ORD record
ord-174e630d9843443a8a8ca5fa7bff0a8c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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