Sodium ion → 3-(2-Chlorophenyl)-2-(4-chlorophenyl)-3-oxopropanenitrile

HRID 184447

Reaction equation

HRID 184447 reaction equation
[CH2:13]([O:15][C:16](=[O:14])[c:17]1[c:18]([Cl:23])[cH:19][cH:20][cH:21][cH:22]1)[CH3:24].[CH2:26]1[O:27][CH2:28][CH2:29][CH2:30]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][C:7]#[N:8])[cH:9][cH:10]1.[H-:12].[Na+:11].[OH2:25]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:6]([C:7]#[N:8])[C:16](=[O:15])[c:17]2[c:18]([Cl:23])[cH:19][cH:20][cH:21][cH:22]2)[cH:9][cH:10]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 962WaterHCID 8028TetrahydrofuranHCID 81783Ethyl 2-chlorobenzoateHCID 166653HydrideHCID 2415824-Chlorobenzyl cyanide

Product 1

HCID 134706313-(2-Chlorophenyl)-2-(4-chlorophenyl)-3-oxopropanenitrile

Sources & evidence

ORD record
ord-e54a5393baf841048c41420677829b22
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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