HRID2149841

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID1140

Toluene

C7H8

HCID8857

Ethyl acetate

C4H8O2

HCID66048

4-Piperidinol, 1-methyl-

C6H13NO

HCID105144

Palladium(2+)

Pd+2

HCID2734215

2-(Di-tert-butylphosphino)biphenyl

C20H27P

HCID15100859

6-Bromopyridine-2-carbonitrile

C6H3BrN2

PRODUCTS

生成物

HCID64594594

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-52b7d54a20604357b8f0852234d7fe97
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[Br:9][c:10]1[cH:11][cH:12][cH:13][c:14]([C:16]#[N:17])[n:15]1.[C:18]([P:19]([C:20]([CH3:21])([CH3:22])[CH3:23])[c:24]1[cH:25][cH:26][cH:27][cH:28][c:29]1-[c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)([CH3:36])([CH3:37])[CH3:38].[CH3:1][N:2]1[CH2:3][CH2:4][CH:5]([OH:8])[CH2:6][CH2:7]1.[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[CH3:46][CH2:47][O:48][C:49]([CH3:50])=[O:51].[O-:53][C:54]([CH3:55])=[O:56].[O-:57][C:58]([CH3:59])=[O:60].[Pd+2:52]>>[CH3:1][N:2]1[CH2:3][CH2:4][CH:5]([O:8][c:10]2[cH:11][cH:12][cH:13][c:14]([C:16]#[N:17])[n:15]2)[CH2:6][CH2:7]1