Water → 1-(4-Chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-one

HRID 295644

Reaction equation

HRID 295644 reaction equation
[CH3:17][CH2:18][N:19]([CH2:20][CH3:21])[CH2:22][CH3:23].[CH3:25][C:26]#[N:27].[Cl:1][CH2:2][C:3](=[O:4])[c:5]1[cH:6][cH:7][c:8]([Cl:11])[cH:9][cH:10]1.[OH2:24].[nH:12]1[n:13][cH:14][n:15][cH:16]1>>[CH2:2]([C:3](=[O:4])[c:5]1[cH:6][cH:7][c:8]([Cl:11])[cH:9][cH:10]1)[n:12]1[n:13][cH:14][n:15][cH:16]1

Participants

6

Reactant 5

HCID 962WaterHCID 6342AcetonitrileHCID 8471TriethylamineHCID 92571H-1,2,4-TriazoleHCID 702982,4'-Dichloroacetophenone

Product 1

HCID 7164721-(4-Chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-one

Sources & evidence

ORD record
ord-abef115ce65340119b4d79e19ed869b3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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