Acetonitrile → 6-(2-Pyrimidinyl)-5-hexyn-1-ol

HRID 1229699Notes

Reaction equation

HRID 1229699 reaction equation
[Br:1][c:2]1[n:3][cH:4][cH:5][cH:6][n:7]1.[CH2:8]([CH2:9][CH2:10][CH2:11][C:12]#[CH:13])[OH:14].[CH3:17][C:18]#[N:19].[Cu:15][I:16]>>[c:2]1([C:13]#[C:12][CH2:11][CH2:10][CH2:9][CH2:8][OH:14])[n:3][cH:4][cH:5][cH:6][n:7]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 702345-Hexyn-1-olHCID 783452-Bromopyrimidine

Product 1

HCID 198767486-(2-Pyrimidinyl)-5-hexyn-1-ol

Sources & evidence

ORD record
ord-71b5b3e4938045e9bd38a46a6ab79312
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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