Ammonium → alpha-(4-Amino-2-chlorophenyl)-4-chloro-alpha-methylbenzeneacetonitrile

HRID 91948Notes

Reaction equation

HRID 91948 reaction equation
[CH3:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1.[Cl-:22].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]([C:9]#[N:10])([CH3:11])[c:12]2[c:13]([Cl:21])[cH:14][c:15]([N+:18]([O-:19])=[O:20])[cH:16][cH:17]2)[cH:6][cH:7]1.[Fe:24].[NH4+:23]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]([C:9]#[N:10])([CH3:11])[c:12]2[c:13]([Cl:21])[cH:14][c:15]([NH2:18])[cH:16][cH:17]2)[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 223AmmoniumHCID 312ChlorideHCID 1140TolueneHCID 23925IronHCID 137703554-Chloro-alpha-(2-chloro-4-nitrophenyl)-alpha-methylbenzeneacetonitrile

Product 1

HCID 13770357alpha-(4-Amino-2-chlorophenyl)-4-chloro-alpha-methylbenzeneacetonitrile

Sources & evidence

ORD record
ord-e777111d9e6b47e28e8c83aa8bbd6ced
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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