Water → 5-methyl-2-(2H-1,2,3-triazol-2-yl)benzoic acid

HRID 293185

Reaction equation

HRID 293185 reaction equation
[CH3:17][NH:18][CH:19]1[CH2:20][CH2:21][CH2:22][CH2:23][CH:24]1[NH:25][CH3:26].[Cu:33][I:34].[I:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8]([CH3:11])[cH:9][cH:10]1.[O:27]=[CH:28][N:29]([CH3:30])[CH3:31].[OH2:32].[nH:12]1[n:13][n:14][cH:15][cH:16]1>>[c:2]1(-[n:13]2[n:12][cH:16][cH:15][n:14]2)[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8]([CH3:11])[cH:9][cH:10]1

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 1429412-Iodo-5-methylbenzoic acidHCID 5510741-N,2-N-dimethylcyclohexane-1,2-diamineHCID 178418936HCID 178418936, compound

Product 1

HCID 532601655-methyl-2-(2H-1,2,3-triazol-2-yl)benzoic acid

Sources & evidence

ORD record
ord-46537df28b704965b5dfd598f9f2afa1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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