Ammonium → 2-(3-Bromo-5-chloro-phenyl)-malonic acid dimethyl ester

HRID 693870Notes

Reaction equation

HRID 693870 reaction equation
[Br:1][c:2]1[cH:3][c:4]([Br:9])[cH:5][c:6]([Cl:8])[cH:7]1.[C:10]([CH2:11][C:12](=[O:13])[O:14][CH3:15])(=[O:16])[O:17][CH3:18].[CH2:23]1[O:24][CH2:25][CH2:26][O:27][CH2:28]1.[Cl:31][CH2:32][Cl:33].[Cu:29][Br:30].[H-:19].[NH4+:22].[Na+:20].[OH-:21]>>[c:2]1([CH:11]([C:10](=[O:16])[O:17][CH3:18])[C:12](=[O:13])[O:14][CH3:15])[cH:3][c:4]([Br:9])[cH:5][c:6]([Cl:8])[cH:7]1

Participants

10

Reactant 9

HCID 223AmmoniumHCID 923Sodium ionHCID 961HydroxideHCID 6344DichloromethaneHCID 7943Dimethyl malonateHCID 24593copper(I) bromideHCID 312751,4-DioxaneHCID 846761,3-Dibromo-5-chlorobenzeneHCID 166653Hydride

Product 1

HCID 574588062-(3-Bromo-5-chloro-phenyl)-malonic acid dimethyl ester

Sources & evidence

ORD record
ord-ceef839a204048878e8e40cf85f851e2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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