Chloride → 1-(4-Methoxy-dibenzofuran-1-yl)-4-oxo-cyclohexane carbonitrile

HRID 178535

Reaction equation

HRID 178535 reaction equation
[CH3:1][O:2][C:3](=[O:4])[CH:5]1[C:6](=[O:28])[CH2:7][CH2:8][C:9]([c:11]2[cH:12][cH:13][c:14]([O:24][CH3:25])[c:15]3[o:16][c:17]4[c:18]([c:19]23)[cH:20][cH:21][cH:22][cH:23]4)([C:26]#[N:27])[CH2:10]1.[CH3:31][S:32]([CH3:33])=[O:34].[Cl-:30].[Na+:29].[OH2:35]>>[CH2:5]1[C:6](=[O:28])[CH2:7][CH2:8][C:9]([c:11]2[cH:12][cH:13][c:14]([O:24][CH3:25])[c:15]3[o:16][c:17]4[c:18]([c:19]23)[cH:20][cH:21][cH:22][cH:23]4)([C:26]#[N:27])[CH2:10]1

Participants

6

Reactant 5

HCID 312ChlorideHCID 679Dimethyl SulfoxideHCID 923Sodium ionHCID 962WaterHCID 247555955-Cyano-5-(4-methoxy-dibenzofuran-1-yl)-2-oxo-cyclohexane carboxylic acid methyl ester

Product 1

HCID 248041271-(4-Methoxy-dibenzofuran-1-yl)-4-oxo-cyclohexane carbonitrile

Sources & evidence

ORD record
ord-ab2cfc1daa8f4fd3899d0715a067bad2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

Loading…