Ammonium → (1R)-1-(2-(Trifluoromethyl)phenyl)ethylamine

HRID 195964

Reaction equation

HRID 195964 reaction equation
[BH4-:1].[CH3:3][O:4][N:5]=[C:6]([CH3:7])[c:8]1[c:9]([C:14]([F:15])([F:16])[F:17])[cH:10][cH:11][cH:12][cH:13]1.[Cl-:26].[Cl-:27].[Cl-:28].[Cl-:29].[NH4+:19].[Na+:2].[O:21]1[CH2:22][CH2:23][CH2:24][CH2:25]1.[OH-:20].[OH2:18].[Zr+4:30]>>[NH2:5][CH:6]([CH3:7])[c:8]1[c:9]([C:14]([F:15])([F:16])[F:17])[cH:10][cH:11][cH:12][cH:13]1

Participants

10

Reactant 9

HCID 223AmmoniumHCID 312Chloride4×HCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 28123BorohydrideHCID 115139Zirconium cation (4+)HCID 545136081-(2-trifluoromethyl-phenyl)-ethanone O-methyl-oxime

Product 1

HCID 2782450(1R)-1-(2-(Trifluoromethyl)phenyl)ethylamine

Sources & evidence

ORD record
ord-c5677cf3287e4d37a109b1d9dccdefb5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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