Ethanol → Diethyl (3-chloro-2,4-difluorobenzoyl)malonate

HRID 285932

Reaction equation

HRID 285932 reaction equation
[C:2]([CH2:3][C:4](=[O:5])[O:6][CH2:7][CH3:8])(=[O:9])[O:10][CH2:11][CH3:12].[C:40]([Cl:41])([Cl:42])([Cl:43])[Cl:44].[CH3:30][CH2:31][OH:32].[CH3:33][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1.[Cl:13][c:14]1[c:15]([F:24])[c:16]([C:17](=[O:18])[Cl:19])[cH:20][cH:21][c:22]1[F:23].[Mg:1].[S:25](=[O:26])(=[O:27])([OH:28])[OH:29]>>[C:2]([CH:3]([C:4](=[O:5])[O:6][CH2:7][CH3:8])[C:17]([c:16]1[c:15]([F:24])[c:14]([Cl:13])[c:22]([F:23])[cH:21][cH:20]1)=[O:18])(=[O:9])[O:10][CH2:11][CH3:12]

Participants

8

Reactant 7

HCID 702EthanolHCID 1118Sulfuric AcidHCID 1140TolueneHCID 5943Carbon TetrachlorideHCID 7761Diethyl MalonateHCID 27735383-Chloro-2,4-difluorobenzoyl chlorideHCID 5462224Magnesium

Product 1

HCID 22077280Diethyl (3-chloro-2,4-difluorobenzoyl)malonate

Sources & evidence

ORD record
ord-6a472ee8e77c47a6b8f31f092e83a20a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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