Chloride → HCID 21472389, compound

HRID 1130523Notes

Reaction equation

HRID 1130523 reaction equation
[C:1](#[CH:2])[C:3]1([OH:11])[CH2:4][N:5]2[CH2:6][CH2:7][CH:8]1[CH2:9][CH2:10]2.[CH2:12]([CH2:13][CH2:14][CH2:15][CH3:16])[O:17][c:18]1[cH:19][cH:20][c:21]([I:24])[cH:22][cH:23]1.[CH3:70][N:71]([CH3:72])[CH:73]=[O:74].[CH3:75][CH2:76][N:77]([CH2:78][CH3:79])[CH2:80][CH3:81].[Cl-:25].[Cu:68][I:69].[Na+:27].[OH-:26].[OH2:28].[Pd:29].[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:49]1([P:50]([c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)[c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[cH:63][cH:64][cH:65][cH:66][cH:67]1>>[C:1](#[C:2][c:21]1[cH:20][cH:19][c:18]([O:17][CH2:12][CH2:13][CH2:14][CH2:15][CH3:16])[cH:23][cH:22]1)[C:3]1([OH:11])[CH2:4][N:5]2[CH2:6][CH2:7][CH:8]1[CH2:9][CH2:10]2

Participants

12

Reactant 11

HCID 312ChlorideHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 11776Triphenylphosphine2×HCID 23938PalladiumHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 36135173-Ethynyl-1-azabicyclo[2.2.2]octan-3-olHCID 21472391HCID 21472391, compound

Product 1

HCID 21472389HCID 21472389, compound

Sources & evidence

ORD record
ord-60761dcbd0bf46fa83b4b5f65f4c0937
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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