Acetone → 3-Fluoro-4-(3-hydroxypropoxy)-benzonitrile

HRID 176231

Reaction equation

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

Participants

Reactant 5

HCID 180Acetone

HCID 813Potassium Cation2×

HCID 123083-Bromo-1-propanol

HCID 19660Carbonate Ion

HCID 27829443-Fluoro-4-hydroxybenzonitrile

Product 1

HCID 436575093-Fluoro-4-(3-hydroxypropoxy)-benzonitrile

Sources & evidence

ORD record: ord-92c41a58e4f8494ea1d20d48bcf5ca81
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

Linked notes

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