Ethanol → 4-[3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1]oct-8-yl]-butylamine

HRID 316639Notes

Reaction equation

HRID 316639 reaction equation
[CH3:27][CH2:28][OH:29].[Cl:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[CH2:9][CH:10]3[CH2:11][CH2:12][CH:13]([CH2:14]2)[N:15]3[CH2:16][CH2:17][CH2:18][CH2:19][NH:20][C:21](=[O:22])[C:23]([F:24])([F:25])[F:26])[cH:6][cH:7]1.[K+:31].[OH-:30]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[CH2:9][CH:10]3[CH2:11][CH2:12][CH:13]([CH2:14]2)[N:15]3[CH2:16][CH2:17][CH2:18][CH2:19][NH2:20])[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 702EthanolHCID 813Potassium CationHCID 961HydroxideHCID 18545195N-{4-[3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1]oct-8-yl]-butyl}-2,2,2-trifluoro-acetamide

Product 1

HCID 185451914-[3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1]oct-8-yl]-butylamine

Sources & evidence

ORD record
ord-2ce8c4d6683b41d4b8bb83eaec209d8a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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