Trifluoroacetic acid → (1RS,2SR)-2-amino-1-(6-fluoropyridin-3-yl)-3-(3-(1,1,2,2-tetrafluoroethoxy)phenyl)-1-propanol

Reaction equation

[CH3:1][C:2]([N:5]([C:3](=[O:4])[O-:6])[CH:9]([CH:10]([OH:11])[c:12]1[cH:13][n:14][c:15]([F:18])[cH:16][cH:17]1)[CH2:19][c:20]1[cH:21][c:22]([O:26][C:27]([CH:28]([F:29])[F:30])([F:31])[F:32])[cH:23][cH:24][cH:25]1)([CH3:7])[CH3:8].[OH:33][C:34]([C:35]([F:36])([F:37])[F:38])=[O:39]>>[NH2:5][CH:9]([CH:10]([OH:11])[c:12]1[cH:13][n:14][c:15]([F:18])[cH:16][cH:17]1)[CH2:19][c:20]1[cH:21][c:22]([O:26][C:27]([CH:28]([F:29])[F:30])([F:31])[F:32])[cH:23][cH:24][cH:25]1

Participants

Reactant 2

HCID 6422Trifluoroacetic acid

HCID 86593258N-tert-butyl-N-[1-(6-fluoropyridin-3-yl)-1-hydroxy-3-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]propan-2-yl]carbamate

Product 1

HCID 22261670(1RS,2SR)-2-amino-1-(6-fluoropyridin-3-yl)-3-(3-(1,1,2,2-tetrafluoroethoxy)phenyl)-1-propanol

Sources & evidence

ORD record: ord-8729a19293f0486cae15757336562310
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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