HRID114625

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID10908

tert-Butyl acetate

C6H12O2

HCID23938

Palladium

HCID95417

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

C17H14O

HCID589711

未命名化合物

结构：CN(C)c1ccccc1-c1ccccc1P(C1CCCCC1)C1CCCCC1

HCID2734217

2-Dicyclohexylphosphino-2'-(N,N-dimethylamino)biphenyl

C26H36NP

HCID12643718

2,4-Dichloro-5-methylpyridine

C6H5Cl2N

PRODUCTS

生成物

HCID86623475

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-680fc4889ac340a3a81eb78d31628419
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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