Ammonium → Dimethyl [2-(2-amino-4-fluorophenyl)-1-phenylethyl]malonate

HRID 1121699Notes

Reaction equation

HRID 1121699 reaction equation
[CH3:1][O:2][C:3]([CH:4]([C:5](=[O:6])[O:7][CH3:8])[CH:9]([CH2:10][c:11]1[c:12]([N+:18]([O-:19])=[O:20])[cH:13][c:14]([F:17])[cH:15][cH:16]1)[c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)=[O:27].[CH3:30][OH:31].[Cl-:28].[NH4+:29].[Zn:32]>>[CH3:1][O:2][C:3]([CH:4]([C:5](=[O:6])[O:7][CH3:8])[CH:9]([CH2:10][c:11]1[c:12]([NH2:18])[cH:13][c:14]([F:17])[cH:15][cH:16]1)[c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)=[O:27]

Participants

6

Reactant 5

HCID 223AmmoniumHCID 312ChlorideHCID 887MethanolHCID 23994ZincHCID 59688514Dimethyl [2-(4-fluoro-2-nitrophenyl)-1-phenylethyl]malonate

Product 1

HCID 58997962Dimethyl [2-(2-amino-4-fluorophenyl)-1-phenylethyl]malonate

Sources & evidence

ORD record
ord-29d1e1a6c3a64352b3fea22bd45117d7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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