Dimethylformamide → 4-[2-(2,6-Dichloro-phenyl)-4-isopropyl-2H-pyrazol-3-ylmethoxy]-2-methyl-benzonitrile

HRID 2126998Notes

Reaction equation

HRID 2126998 reaction equation
[C:29](=[O:30])([O-:31])[O-:32].[Cl:1][c:2]1[c:3](-[n:9]2[n:10][cH:11][c:12]([CH:16]([CH3:17])[CH3:18])[c:13]2[CH2:14][OH:15])[c:4]([Cl:8])[cH:5][cH:6][cH:7]1.[Cs+:33].[Cs+:34].[F:19][c:20]1[cH:21][c:22]([CH3:28])[c:23]([C:24]#[N:25])[cH:26][cH:27]1.[O:35]=[CH:36][N:37]([CH3:38])[CH3:39]>>[Cl:1][c:2]1[c:3](-[n:9]2[n:10][cH:11][c:12]([CH:16]([CH3:17])[CH3:18])[c:13]2[CH2:14][O:15][c:20]2[cH:21][c:22]([CH3:28])[c:23]([C:24]#[N:25])[cH:26][cH:27]2)[c:4]([Cl:8])[cH:5][cH:6][cH:7]1

Participants

6

Reactant 5

HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 38260554-Fluoro-2-methylbenzonitrileHCID 57443256(1-(2,6-dichlorophenyl)-4-isopropyl-1H-pyrazol-5-yl)methanol

Product 1

HCID 675281824-[2-(2,6-Dichloro-phenyl)-4-isopropyl-2H-pyrazol-3-ylmethoxy]-2-methyl-benzonitrile

Sources & evidence

ORD record
ord-bfb07b74df124da2ac4a532b215fae2e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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