Acetonitrile → 5-Nitro-2-prop-1-ynyl-phenylamine

HRID 116148

Reaction equation

HRID 116148 reaction equation
[Br:1][c:2]1[c:3]([NH2:4])[cH:5][c:6]([N+:9](=[O:10])[O-:11])[cH:7][cH:8]1.[CH2:12]([N:13]([CH2:14][CH3:15])[CH2:17][CH3:18])[CH3:16].[CH3:19][C:20]#[N:21].[Cu:22][I:23]>>[c:2]1([C:19]#[C:17][CH3:18])[c:3]([NH2:4])[cH:5][c:6]([N+:9](=[O:10])[O-:11])[cH:7][cH:8]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 826072-Bromo-5-nitroaniline

Product 1

HCID 671007405-Nitro-2-prop-1-ynyl-phenylamine

Sources & evidence

ORD record
ord-e7847b8403b840fe8d33096555de1081
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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