Acetate → p-Nitrocinnamonitrile

HRID 1204487Notes

Reaction equation

HRID 1204487 reaction equation
[C:1](#[N:2])[CH2:3][C:4]([OH:5])=[O:6].[CH3:19][C:20](=[O:21])[O-:22].[CH3:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[N+:7](=[O:8])([O-:9])[c:10]1[cH:11][cH:12][c:13]([CH:14]=[O:15])[cH:16][cH:17]1.[NH4+:18].[cH:30]1[cH:31][cH:32][n:33][cH:34][cH:35]1>>[C:1](#[N:2])[CH:3]=[CH:14][c:13]1[cH:12][cH:11][c:10]([N+:7](=[O:8])[O-:9])[cH:17][cH:16]1

Participants

7

Reactant 6

HCID 175AcetateHCID 223AmmoniumHCID 5414-NitrobenzaldehydeHCID 1049PyridineHCID 1140TolueneHCID 9740Cyanoacetic acid

Product 1

HCID 34056p-Nitrocinnamonitrile

Sources & evidence

ORD record
ord-e8c24fa8582845b69a99230ea20b7173
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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