1,2-Dichloroethane → 2-(2-Fluoro-pyridin-4-yl)-2-cyclo-pentylamino-1-(3-trifluoromethyl-phenyl)-ethanol

HRID 153201Notes

Reaction equation

HRID 153201 reaction equation
[Cl:33][CH2:34][CH2:35][Cl:36].[NH2:1][CH:2]([CH:3]([OH:4])[c:5]1[cH:6][c:7]([C:11]([F:12])([F:13])[F:14])[cH:8][cH:9][cH:10]1)[c:15]1[cH:16][c:17]([F:21])[n:18][cH:19][cH:20]1.[Na+:32].[O-:28][C:29]([OH:30])=[O:31].[O:22]=[C:23]1[CH2:24][CH2:25][CH2:26][CH2:27]1>>[NH:1]([CH:2]([CH:3]([OH:4])[c:5]1[cH:6][c:7]([C:11]([F:12])([F:13])[F:14])[cH:8][cH:9][cH:10]1)[c:15]1[cH:16][c:17]([F:21])[n:18][cH:19][cH:20]1)[CH:23]1[CH2:24][CH2:25][CH2:26][CH2:27]1

Participants

6

Reactant 5

HCID 111,2-DichloroethaneHCID 769Bicarbonate IonHCID 923Sodium ionHCID 8452CyclopentanoneHCID 155242512-Amino-2-(2-fluoropyridine-4-yl)-1-(3-trifluoromethylphenyl)ethanol

Product 1

HCID 155242522-(2-Fluoro-pyridin-4-yl)-2-cyclo-pentylamino-1-(3-trifluoromethyl-phenyl)-ethanol

Sources & evidence

ORD record
ord-ca5c78812c074aae8c07f1fff71b7667
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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