Potassium Cation → 2-(4-Chloro-2-nitro-phenylamino)-5-isopropyl-benzonitrile

HRID 690956Notes

Reaction equation

HRID 690956 reaction equation
[C:24](=[O:25])([O-:26])[O-:27].[CH3:30][N:31]([CH3:32])[CH:33]=[O:34].[CH3:35][CH2:36][O:37][C:38](=[O:39])[CH3:40].[Cl:1][c:2]1[c:3]([N+:9](=[O:10])[O-:11])[cH:4][c:5]([Cl:8])[cH:6][cH:7]1.[Cu:41].[K+:28].[K+:29].[NH2:12][c:13]1[c:14]([C:15]#[N:16])[cH:17][c:18]([CH:21]([CH3:22])[CH3:23])[cH:19][cH:20]1>>[c:2]1([NH:12][c:13]2[c:14]([C:15]#[N:16])[cH:17][c:18]([CH:21]([CH3:22])[CH3:23])[cH:19][cH:20]2)[c:3]([N+:9](=[O:10])[O-:11])[cH:4][c:5]([Cl:8])[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 69772,5-DichloronitrobenzeneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 23978CopperHCID 210934632-Amino-5-isopropylbenzonitrile

Product 1

HCID 586259132-(4-Chloro-2-nitro-phenylamino)-5-isopropyl-benzonitrile

Sources & evidence

ORD record
ord-43033dbfdf39410b969f1371a84e795b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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