HRID102504

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7467

1-(4-Chlorophenyl)ethanone

C8H7ClO

HCID7501

Styrene

C8H8

HCID8028

Tetrahydrofuran

C4H8O

HCID23938

Palladium

2 次

HCID95417

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

C17H14O

3 次

HCID4060964

未命名化合物

结构：Cc1ccc([B-](c2ccc(C)cc2)(c2ccc(C)cc2)c2ccc(C)cc2)cc1

HCID4608326

未命名化合物

HCID10774245

α-Cyclohexylcyclohexanemethanamine

C13H25N

PRODUCTS

生成物

HCID610211

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3d79b05ac9b44538838adac5d3571084
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:62]([PH+:63]([C:64]([CH3:65])([CH3:66])[CH3:67])[C:68]([CH3:69])([CH3:70])[CH3:71])([CH3:72])([CH3:73])[CH3:74].[CH2:11]=[CH:12][c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1.[CH:19]1([CH:20]([NH2:21])[CH:22]2[CH2:23][CH2:24][CH2:25][CH2:26][CH2:27]2)[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]([CH3:9])=[O:10])[cH:6][cH:7]1.[O:113]=[C:114]([CH:115]=[CH:116][c:117]1[cH:118][cH:119][cH:120][cH:121][cH:122]1)[CH:123]=[CH:124][c:125]1[cH:126][cH:127][cH:128][cH:129][cH:130]1.[O:131]1[CH2:132][CH2:133][CH2:134][CH2:135]1.[O:77]=[C:78]([CH:79]=[CH:80][c:81]1[cH:82][cH:83][cH:84][cH:85][cH:86]1)[CH:87]=[CH:88][c:89]1[cH:90][cH:91][cH:92][cH:93][cH:94]1.[O:95]=[C:96]([CH:97]=[CH:98][c:99]1[cH:100][cH:101][cH:102][cH:103][cH:104]1)[CH:105]=[CH:106][c:107]1[cH:108][cH:109][cH:110][cH:111][cH:112]1.[Pd:75].[Pd:76].[c:33]1([CH3:34])[cH:35][cH:36][c:37]([B-:38]([c:39]2[cH:40][cH:41][c:42]([CH3:43])[cH:44][cH:45]2)([c:46]2[cH:47][cH:48][c:49]([CH3:50])[cH:51][cH:52]2)[c:53]2[cH:54][cH:55][c:56]([CH3:57])[cH:58][cH:59]2)[cH:60][cH:61]1>>[c:2]1([CH:11]=[CH:12][c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[cH:3][cH:4][c:5]([C:8]([CH3:9])=[O:10])[cH:6][cH:7]1