Potassium Cation → 3-(4-(6-Fluorobenzo[d]isoxazol-3-yl)piperidin-1-yl)propan-1-ol

HRID 125697

Reaction equation

HRID 125697 reaction equation
[Br:23][CH2:24][CH2:25][CH2:26][OH:27].[CH2:28]([OH:29])[CH2:30][CH3:31].[CH3:33][C:34]#[N:35].[F:1][c:2]1[cH:3][c:4]2[c:5]([c:6]([CH:9]3[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]3)[n:7][o:8]2)[cH:15][cH:16]1.[K+:17].[K+:18].[O-:19][C:20]([O-:21])=[O:22].[OH2:32]>>[F:1][c:2]1[cH:3][c:4]2[c:5]([c:6]([CH:9]3[CH2:10][CH2:11][N:12]([CH2:24][CH2:25][CH2:26][OH:27])[CH2:13][CH2:14]3)[n:7][o:8]2)[cH:15][cH:16]1

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 962WaterHCID 10311-PropanolHCID 6342AcetonitrileHCID 123083-Bromo-1-propanolHCID 19660Carbonate IonHCID 8494213-(4-Piperidyl)-6-fluoro-1,2-benzisoxazole

Product 1

HCID 153849663-(4-(6-Fluorobenzo[d]isoxazol-3-yl)piperidin-1-yl)propan-1-ol

Sources & evidence

ORD record
ord-4b040ff0bde941fc9ccd9f6475398d3d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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