Potassium Cation → 2-[2-(3-Tert-butyl-phenoxy)-ethyl]-[1,3]dioxane

HRID 193173

Reaction equation

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

Participants

Reactant 5

HCID 813Potassium Cation2×

HCID 6342Acetonitrile

HCID 11450Phenol, 3-(1,1-dimethylethyl)-

HCID 19660Carbonate Ion

HCID 5206561,3-Dioxane, 2-(2-bromoethyl)-

Product 1

HCID 595485522-[2-(3-Tert-butyl-phenoxy)-ethyl]-[1,3]dioxane

Sources & evidence

ORD record: ord-72705e0febbb4758b4cde51409527eba
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

Linked notes

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