HRID297998

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6658

Methyl methacrylate

C5H8O2

HCID23938

Palladium

2 次

HCID31275

1,4-Dioxane

C4H8O2

HCID32885

2-Chloro-1,3-dimethylbenzene

C8H9Cl

HCID95417

1,5-Diphenyl-1,4-pentadien-3-one

C17H14O

3 次

HCID10774245

α-Cyclohexylcyclohexanemethanamine

C13H25N

PRODUCTS

生成物

HCID66772814

Methyl 3-(2,6-dimethylphenyl)-2-methylprop-2-enoate

C13H16O2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-296c38185ed14431b47bf678d227eba3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH2:87]1[O:88][CH2:89][CH2:90][O:91][CH2:92]1.[CH3:10][O:11][C:12](=[O:13])[C:14]([CH3:15])=[CH2:16].[CH:17]1([CH:18]([NH2:19])[CH:20]2[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25]2)[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]1.[Cl:1][c:2]1[c:3]([CH3:9])[cH:4][cH:5][cH:6][c:7]1[CH3:8].[O:33]=[C:34]([CH:35]=[CH:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1)[CH:43]=[CH:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[O:51]=[C:52]([CH:53]=[CH:54][c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1)[CH:61]=[CH:62][c:63]1[cH:64][cH:65][cH:66][cH:67][cH:68]1.[O:69]=[C:70]([CH:71]=[CH:72][c:73]1[cH:74][cH:75][cH:76][cH:77][cH:78]1)[CH:79]=[CH:80][c:81]1[cH:82][cH:83][cH:84][cH:85][cH:86]1.[Pd:31].[Pd:32]>>[c:2]1([CH:15]=[C:14]([C:12]([O:11][CH3:10])=[O:13])[CH3:16])[c:3]([CH3:9])[cH:4][cH:5][cH:6][c:7]1[CH3:8]