Water → 4-(4-Methoxy-3-methylphenyl)but-3-yn-1-ol

HRID 1148757Notes

Reaction equation

HRID 1148757 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([O:9][CH3:10])[c:6]([CH3:8])[cH:7]1.[CH2:11]([CH2:12][C:13]#[CH:14])[OH:15].[CH3:16][CH2:17][N:18]([CH2:19][CH3:20])[CH2:21][CH3:22].[Cu:29][I:30].[O:24]=[CH:25][N:26]([CH3:27])[CH3:28].[OH2:23].[Pd:31]([Cl:32])[Cl:33].[c:34]1([P:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:48][cH:49][cH:50][cH:51][cH:52]1.[c:53]1([P:54]([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[cH:67][cH:68][cH:69][cH:70][cH:71]1>>[c:2]1([C:14]#[C:13][CH2:12][CH2:11][OH:15])[cH:3][cH:4][c:5]([O:9][CH3:10])[c:6]([CH3:8])[cH:7]1

Participants

9

Reactant 8

HCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 11776Triphenylphosphine2×HCID 135663-Butyn-1-OLHCID 24290Palladium ChlorideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 6083154-Bromo-1-methoxy-2-methylbenzene

Product 1

HCID 607996814-(4-Methoxy-3-methylphenyl)but-3-yn-1-ol

Sources & evidence

ORD record
ord-cb401d3a9b214fbabeaf92705085f3fb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

Loading…