Beta-Alanine → 2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]propanedinitrile

HRID 822065

Reaction equation

HRID 822065 reaction equation
[CH2:1]1[O:2][c:3]2[cH:4][c:5]([CH:6]=[O:7])[c:8]([N+:12](=[O:13])[O-:14])[cH:9][c:10]2[O:11]1.[CH3:27][CH2:28][OH:29].[N:15]#[C:16][CH2:17][C:18]#[N:19].[NH2:20][CH2:21][CH2:22][C:23]([OH:24])=[O:25].[OH2:26]>>[CH2:1]1[O:2][c:3]2[cH:4][c:5]([CH:6]=[C:17]([C:16]#[N:15])[C:18]#[N:19])[c:8]([N+:12](=[O:13])[O-:14])[cH:9][c:10]2[O:11]1

Participants

6

Reactant 5

HCID 239Beta-AlanineHCID 702EthanolHCID 962WaterHCID 8010MalononitrileHCID 128406-Nitro-1,3-benzodioxole-5-carboxaldehyde

Product 1

HCID 7079142-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]propanedinitrile

Sources & evidence

ORD record
ord-8d35e71d76414917af69c75d55d834dc
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Linked notes

Loading…