Ammonia → Methyl 4-bromo-2-cyanobenzoate

HRID 117506Notes

Reaction equation

HRID 117506 reaction equation
[Br:1][c:2]1[cH:3][c:4]([I:12])[c:5]([C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11]1.[CH3:21][CH2:22][O:23][C:24](=[O:25])[CH3:26].[CH3:28][N:29]1[CH2:30][CH2:31][CH2:32][C:33]1=[O:34].[Cl-:18].[Cu:13]([C:14]#[N:15])[C:16]#[N:17].[NH3:20].[NH4+:19].[OH2:27]>>[Br:1][c:2]1[cH:3][c:4]([C:14]#[N:15])[c:5]([C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11]1

Participants

9

Reactant 8

HCID 222AmmoniaHCID 223AmmoniumHCID 312ChlorideHCID 962WaterHCID 8857Ethyl AcetateHCID 13387N-methyl-2-pyrrolidoneHCID 58484707Methyl 4-bromo-2-iodobenzoateHCID 178418260HCID 178418260, compound

Product 1

HCID 58484706Methyl 4-bromo-2-cyanobenzoate

Sources & evidence

ORD record
ord-67fbe0eaf440443ca9756e73e38088cb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

Loading…