HRID932578

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID8471

Triethylamine

C6H15N

HCID8821

Ethyl acrylate

C5H8O2

HCID11776

Triphenylphosphine

C18H15P

HCID23938

Palladium

2 次

HCID95417

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

C17H14O

3 次

HCID18980002

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C=Cc1c(OC)c(=O)[nH]c2cc(Cl)ccc2c1=O

HCID54183736

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b1aedd7d8344495eb8a95443e80d0f67
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:37]([CH:38]=[CH2:39])(=[O:40])[O:41][CH2:42][CH3:43].[CH3:44][CH2:45][N:46]([CH2:47][CH3:48])[CH2:49][CH3:50].[CH3:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1.[Cl:20][c:21]1[cH:22][cH:23][c:24]2[c:25]([nH:26][c:27](=[O:35])[c:28]([O:33][CH3:34])[c:29]([I:32])[c:30]2=[O:31])[cH:36]1.[O:60]=[C:61]([CH:62]=[CH:63][c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1)[CH:70]=[CH:71][c:72]1[cH:73][cH:74][cH:75][cH:76][cH:77]1.[O:78]=[C:79]([CH:80]=[CH:81][c:82]1[cH:83][cH:84][cH:85][cH:86][cH:87]1)[CH:88]=[CH:89][c:90]1[cH:91][cH:92][cH:93][cH:94][cH:95]1.[O:96]=[C:97]([CH:98]=[CH:99][c:100]1[cH:101][cH:102][cH:103][cH:104][cH:105]1)[CH:106]=[CH:107][c:108]1[cH:109][cH:110][cH:111][cH:112][cH:113]1.[Pd:58].[Pd:59].[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[Cl:20][c:21]1[cH:22][cH:23][c:24]2[c:25]([nH:26][c:27](=[O:35])[c:28]([O:33][CH3:34])[c:29]([CH:39]=[CH:38][C:37](=[O:40])[O:41][CH2:42][CH3:43])[c:30]2=[O:31])[cH:36]1