Acetone → Methyl 2-chloro-3-[4-(2-hydroxyethyl)phenyl]propanoate

HRID 164187

Reaction equation

HRID 164187 reaction equation
[C:16]([CH:17]=[CH2:18])(=[O:19])[O:20][CH3:21].[CH3:22][C:23](=[O:24])[CH3:25].[ClH:11].[Cu:27][I:28].[N:12]([O-:13])=[O:14].[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][OH:10])[cH:6][cH:7]1.[Na+:15].[OH2:26]>>[c:2]1([CH2:18][CH:17]([Cl:11])[C:16](=[O:19])[O:20][CH3:21])[cH:3][cH:4][c:5]([CH2:8][CH2:9][OH:10])[cH:6][cH:7]1

Participants

9

Reactant 8

HCID 180AcetoneHCID 313Hydrochloric AcidHCID 923Sodium ionHCID 946NitriteHCID 962WaterHCID 7294Methyl AcrylateHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 669044-Aminophenethyl alcohol

Product 1

HCID 86600802Methyl 2-chloro-3-[4-(2-hydroxyethyl)phenyl]propanoate

Sources & evidence

ORD record
ord-23c641bedef44f059e15165dde7549b3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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