Pyridine → 4-Hexanamidophthalonitrile

Reaction equation

[C:12]([CH2:13][CH2:14][CH2:15][CH2:16][CH3:17])(=[O:18])[Cl:19].[Cl:26][CH2:27][Cl:28].[NH2:1][c:2]1[cH:3][c:4]([C:10]#[N:11])[c:5]([C:6]#[N:7])[cH:8][cH:9]1.[cH:20]1[cH:21][cH:22][n:23][cH:24][cH:25]1>>[NH:1]([c:2]1[cH:3][c:4]([C:10]#[N:11])[c:5]([C:6]#[N:7])[cH:8][cH:9]1)[C:12]([CH2:13][CH2:14][CH2:15][CH2:16][CH3:17])=[O:18]

Participants

Reactant 4

HCID 1049Pyridine

HCID 6344Dichloromethane

HCID 67340Hexanoyl chloride

HCID 925291,2-Benzenedicarbonitrile, 4-amino-

Product 1

HCID 184663724-Hexanamidophthalonitrile

Sources & evidence

ORD record: ord-232f4cac037148edadb4b01d1d75800b
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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