Water → HCID 23156218, compound

HRID 2140743Notes

Reaction equation

HRID 2140743 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([I:12])[n:6][n:7]([CH3:11])[c:8]2[cH:9][cH:10]1.[CH3:13][O:14][CH2:15][C:16]#[CH:17].[CH3:18][N:19]([CH3:20])[CH:21]=[O:22].[CH3:23][CH2:24][N:25]([CH2:26][CH3:27])[CH2:28][CH3:29].[Cu:31][I:32].[OH2:30].[Pd:33]([Cl:34])[Cl:35].[c:36]1([P:37]([c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[cH:50][cH:51][cH:52][cH:53][cH:54]1.[c:55]1([P:56]([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)[cH:69][cH:70][cH:71][cH:72][cH:73]1>>[Br:1][c:2]1[cH:3][c:4]2[c:5]([C:17]#[C:16][CH2:15][O:14][CH3:13])[n:6][n:7]([CH3:11])[c:8]2[cH:9][cH:10]1

Participants

9

Reactant 8

HCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 11776Triphenylphosphine2×HCID 24290Palladium ChlorideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 693933-MethoxypropyneHCID 231562265-bromo-3-iodo-1-methyl-1H-indazole

Product 1

HCID 23156218HCID 23156218, compound

Sources & evidence

ORD record
ord-05c21a774640411f960a6e0280bd091d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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