Ethylene Glycol → 9-(4-Bromo-2-fluorophenyl)-2-(4-hydroxycyclohexyl)-2,9-diazaspiro[4.5]decan-1-one

HRID 199008Notes

Reaction equation

HRID 199008 reaction equation
[Br:19][c:20]1[cH:21][c:22]([F:27])[c:23]([I:26])[cH:24][cH:25]1.[CH2:36]([OH:37])[CH2:38][OH:39].[CH2:40]([OH:41])[CH2:42][CH2:43][CH3:44].[Cu:45][I:46].[K+:33].[K+:34].[K+:35].[OH:1][CH:2]1[CH2:3][CH2:4][CH:5]([N:8]2[C:9](=[O:18])[C:10]3([CH2:11][CH2:12]2)[CH2:13][NH:14][CH2:15][CH2:16][CH2:17]3)[CH2:6][CH2:7]1.[P:28]([O-:29])([O-:30])([O-:31])=[O:32]>>[OH:1][CH:2]1[CH2:3][CH2:4][CH:5]([N:8]2[C:9](=[O:18])[C:10]3([CH2:11][CH2:12]2)[CH2:13][N:14]([c:23]2[c:22]([F:27])[cH:21][c:20]([Br:19])[cH:25][cH:24]2)[CH2:15][CH2:16][CH2:17]3)[CH2:6][CH2:7]1

Participants

8

Reactant 7

HCID 174Ethylene GlycolHCID 2631-ButanolHCID 813Potassium Cation3×HCID 1061PhosphateHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 27245164-Bromo-2-fluoro-1-iodobenzeneHCID 579709392-(4-Hydroxycyclohexyl)-2,9-diazaspiro[4.5]decan-1-one

Product 1

HCID 765478979-(4-Bromo-2-fluorophenyl)-2-(4-hydroxycyclohexyl)-2,9-diazaspiro[4.5]decan-1-one

Sources & evidence

ORD record
ord-cbeaa50982914ce0b95453f965b15953
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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