Ethyl Acetate → 2-Amino-5-isopropylbenzonitrile

HRID 148465

Reaction equation

HRID 148465 reaction equation
[Br:4][c:5]1[c:6]([NH2:14])[cH:7][cH:8][c:9]([CH:11]([CH3:12])[CH3:13])[cH:10]1.[CH3:15][N:16]1[CH2:17][CH2:18][CH2:19][C:20]1=[O:21].[CH3:22][CH2:23][O:24][C:25](=[O:26])[CH3:27].[Cu:1][C:2]#[N:3]>>[C:2](#[N:3])[c:5]1[c:6]([NH2:14])[cH:7][cH:8][c:9]([CH:11]([CH3:12])[CH3:13])[cH:10]1

Participants

5

Reactant 4

HCID 8857Ethyl AcetateHCID 13387N-methyl-2-pyrrolidoneHCID 5213372-Bromo-4-isopropylanilineHCID 178418546HCID 178418546, compound

Product 1

HCID 210934632-Amino-5-isopropylbenzonitrile

Sources & evidence

ORD record
ord-b396a780089b47dba0f7e095b3ec9023
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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