Water → HCID 69102413, compound

HRID 1126690Notes

Reaction equation

HRID 1126690 reaction equation
[C:22](#[CH:23])[c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[CH3:98][CH2:99][O:100][C:101]([CH3:102])=[O:103].[Cu:55][I:56].[NH2:1][c:2]1[c:3]([C:19](=[O:20])[NH2:21])[n:4][c:5](-[c:9]2[cH:10][n:11]([CH:16]([CH3:17])[CH3:18])[c:12](=[O:15])[cH:13][cH:14]2)[c:6]([Cl:8])[n:7]1.[O:50]=[CH:51][N:52]([CH3:53])[CH3:54].[OH2:49].[Pd:57]([Cl:58])[Cl:59].[c:30]1([P:31]([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[cH:44][cH:45][cH:46][cH:47][cH:48]1.[c:60]1([P:61]([c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)[c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[cH:74][cH:75][cH:76][cH:77][cH:78]1.[c:79]1([P:80]([c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)[c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)[cH:93][cH:94][cH:95][cH:96][cH:97]1>>[NH2:1][c:2]1[c:3]([C:19](=[O:20])[NH2:21])[n:4][c:5](-[c:9]2[cH:10][n:11]([CH:16]([CH3:17])[CH3:18])[c:12](=[O:15])[cH:13][cH:14]2)[c:6]([C:23]#[C:22][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[n:7]1

Participants

9

Reactant 8

HCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 10821PhenylacetyleneHCID 11776Triphenylphosphine3×HCID 24290Palladium ChlorideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 86598204HCID 86598204, compound

Product 1

HCID 69102413HCID 69102413, compound

Sources & evidence

ORD record
ord-881806a83a384003b7be10c184cd01ad
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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