Sodium ion → (1,1'-Biphenyl)-4-carbonitrile

HRID 2154980Notes

Reaction equation

HRID 2154980 reaction equation
[Na+:1].[Na+:2].[O-:3][S:4](=[O:5])(=[O:6])[O-:7].[OH:27][NH3+:28].[OH:29][NH3+:30].[S:22]([O-:23])([O-:24])(=[O:25])=[O:26].[c:8]1(-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:9][cH:10][c:11]([CH:14]=[O:15])[cH:12][cH:13]1>>[c:8]1(-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:9][cH:10][c:11]([C:14]#[N:28])[cH:12][cH:13]1

Participants

5

Reactant 4

HCID 923Sodium ion2×HCID 933Hydroxyammonium2×HCID 1117Sulfate Ion2×HCID 76689(1,1'-Biphenyl)-4-carboxaldehyde

Product 1

HCID 18021(1,1'-Biphenyl)-4-carbonitrile

Sources & evidence

ORD record
ord-6d62d356bb9b4bc78352ecb4c36691ac
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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