Potassium Cation → HCID 57664740, compound

HRID 2333571Notes

Reaction equation

HRID 2333571 reaction equation
[C:24](=[O:25])([O-:26])[O-:27].[CH2:30]([CH2:31][C:32]#[CH:33])[c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1.[CH:1]1([NH:4][C:5](=[O:6])[c:7]2[n:8][n:9][n:10](-[c:12]3[c:13]([I:23])[cH:14][c:15]([C:18](=[O:19])[NH:20][CH2:21][CH3:22])[cH:16][cH:17]3)[cH:11]2)[CH2:2][CH2:3]1.[Cu:45][I:46].[K+:28].[K+:29].[O:40]=[CH:41][N:42]([CH3:43])[CH3:44].[Pd:47]([Cl:48])[Cl:49].[c:50]1([P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[cH:64][cH:65][cH:66][cH:67][cH:68]1.[c:69]1([P:70]([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)[c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[cH:83][cH:84][cH:85][cH:86][cH:87]1>>[CH:1]1([NH:4][C:5](=[O:6])[c:7]2[n:8][n:9][n:10](-[c:12]3[c:13]([C:33]#[C:32][CH2:31][CH2:30][c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[cH:14][c:15]([C:18](=[O:19])[NH:20][CH2:21][CH3:22])[cH:16][cH:17]3)[cH:11]2)[CH2:2][CH2:3]1

Participants

9

Reactant 8

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 11776Triphenylphosphine2×HCID 19660Carbonate IonHCID 24290Palladium ChlorideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 1233604-Phenyl-1-butyneHCID 57664776HCID 57664776, compound

Product 1

HCID 57664740HCID 57664740, compound

Sources & evidence

ORD record
ord-c11883db3baf439b91f5a8d09d80c8d3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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