2-Methyl-3-butyn-2-ol → 2-Methyl-4-(4-propylphenyl)-3-butyn-2-ol

HRID 1559349Notes

Reaction equation

HRID 1559349 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][CH3:10])[cH:6][cH:7]1.[CH3:11][C:12]([C:13]#[CH:14])([CH3:15])[OH:16].[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[Cu:84][I:85].[Pd:43]([Cl:44])[Cl:45].[c:17]1([P:18]([c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[cH:31][cH:32][cH:33][cH:34][cH:35]1.[c:46]1([P:47]([c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[cH:60][cH:61][cH:62][cH:63][cH:64]1.[c:65]1([P:66]([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[cH:79][cH:80][cH:81][cH:82][cH:83]1>>[c:2]1([C:14]#[C:13][C:12]([CH3:11])([CH3:15])[OH:16])[cH:3][cH:4][c:5]([CH2:8][CH2:9][CH3:10])[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 82582-Methyl-3-butyn-2-olHCID 8471TriethylamineHCID 11776Triphenylphosphine3×HCID 24290Palladium ChlorideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 1363741-Bromo-4-propylbenzene

Product 1

HCID 152397712-Methyl-4-(4-propylphenyl)-3-butyn-2-ol

Sources & evidence

ORD record
ord-35cb8e3d7d1f4dba9e47be6b51e86ea1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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