Ethyl Acetate → 4-Bromo-2-nitrobenzonitrile

Reaction equation

[Br:1][c:2]1[c:3]([N+:9](=[O:10])[O-:11])[cH:4][c:5]([Br:8])[cH:6][cH:7]1.[CH3:15][CH2:16][O:17][C:18]([CH3:19])=[O:20].[Cu:12][C:13]#[N:14]>>[c:2]1([C:13]#[N:14])[c:3]([N+:9](=[O:10])[O-:11])[cH:4][c:5]([Br:8])[cH:6][cH:7]1

Participants

Reactant 3

HCID 8857Ethyl Acetate

HCID 770041,4-Dibromo-2-nitrobenzene

HCID 178418546HCID 178418546, compound

Product 1

HCID 2925354-Bromo-2-nitrobenzonitrile

Sources & evidence

ORD record: ord-407bda97bcdd4ca5a33f21a9ca5938d0
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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