HRID2330743

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID9987

p-Fluoroanisole

C7H7FO

HCID29568

1-Bromo-2,6-dichlorobenzene

C6H3BrCl2

HCID61668

Boronic acid

H3BO2

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420554

未命名化合物

PRODUCTS

生成物

HCID58646955

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0ab0af703cd34543a73f71c61673dc32
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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