Dimethyl Sulfoxide → 2-(4-Chloro-2-nitro-phenylamino)-5-methyl-benzonitrile

HRID 2156676Notes

Reaction equation

HRID 2156676 reaction equation
[CH3:26][S:27]([CH3:28])=[O:29].[CH3:30][CH2:31][O:32][C:33](=[O:34])[CH3:35].[Cl:11][c:12]1[cH:13][c:14]([N+:19](=[O:20])[O-:21])[c:15]([NH2:18])[cH:16][cH:17]1.[F:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][c:7]([CH3:10])[cH:8][cH:9]1.[Li+:24].[OH-:23].[OH2:22].[OH2:25]>>[c:2]1([NH:18][c:15]2[c:14]([N+:19](=[O:20])[O-:21])[cH:13][c:12]([Cl:11])[cH:17][cH:16]2)[c:3]([C:4]#[N:5])[cH:6][c:7]([CH3:10])[cH:8][cH:9]1

Participants

8

Reactant 7

HCID 679Dimethyl SulfoxideHCID 961HydroxideHCID 962Water2×HCID 69794-Chloro-2-nitroanilineHCID 8857Ethyl AcetateHCID 28486Lithium ionHCID 27745842-Fluoro-5-methylbenzonitrile

Product 1

HCID 586258892-(4-Chloro-2-nitro-phenylamino)-5-methyl-benzonitrile

Sources & evidence

ORD record
ord-2572ba4f2e734560b2df0c454a53cbdf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…