Acetonitrile → HCID 22599666, compound

HRID 138510Notes

Reaction equation

HRID 138510 reaction equation
[CH3:15][CH2:16][N:17]([CH2:18][CH3:19])[CH2:20][CH3:21].[CH3:41][O:42][C:43]([CH3:44])([CH3:45])[CH3:46].[CH3:50][C:51]#[N:52].[CH3:9][C:10]([C:11]#[CH:12])([CH3:13])[CH3:14].[Cl:1][c:2]1[n:3][cH:4][n:5][c:6]([Cl:8])[cH:7]1.[Cu:47]([I:48])[I:49].[c:22]1([P:23]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[cH:36][cH:37][cH:38][cH:39][cH:40]1>>[Cl:1][c:2]1[n:3][cH:4][n:5][c:6]([C:12]#[C:11][C:10]([CH3:9])([CH3:13])[CH3:14])[cH:7]1

Participants

8

Reactant 7

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 11776TriphenylphosphineHCID 135123,3-Dimethyl-1-butyneHCID 15413tert-Butyl methyl etherHCID 709434,6-DichloropyrimidineHCID 83717Copper iodide

Product 1

HCID 22599666HCID 22599666, compound

Sources & evidence

ORD record
ord-d747286d910741a897c7dfc59fe126cc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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