HRID825804

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

3 次

HCID947

Nitrogen

HCID1061

Phosphate

O4P-3

HCID1140

Toluene

C7H8

HCID23938

Palladium

2 次

HCID95417

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

C17H14O

3 次

HCID606256

3-Bromo-5-chloropyridine

C5H3BrClN

HCID2773302

N-Boc-indole-2-boronic acid

C13H16BNO4

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)n1c(-c2cncc(Cl)c2)cc2ccccc21

HCID67093544

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a67e63a85152435fb520c45105050dfe
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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