HRID1123008

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID784

Hydrogen peroxide

H2O2

HCID923

Sodium ion

Na+

3 次

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID11994

Benzene, 1,2-diiodo-

C6H4I2

HCID19660

Carbonate

CO3-2

HCID79799

p-Tolueneboronic acid

C7H9BO2

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

HCID12494664

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f222c92cbe03421d8e32ca488096f942
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH3:15][c:16]1[cH:17][cH:18][c:19]([B:22]([OH:23])[OH:24])[cH:20][cH:21]1.[CH3:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[Cl-:28].[I:1][c:2]1[c:3]([I:8])[cH:4][cH:5][cH:6][cH:7]1.[Na+:10].[Na+:27].[Na+:9].[O-:11][C:12](=[O:13])[O-:14].[OH2:36].[OH:25][OH:26].[cH:37]1[cH:38][cH:39][c:40]([P:41]([Pd:42]([P:43]([c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)([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)([P:62]([c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)([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)[P:81]([c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)([c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)[c:94]2[cH:95][cH:96][cH:97][cH:98][cH:99]2)([c:100]2[cH:101][cH:102][cH:103][cH:104][cH:105]2)[c:106]2[cH:107][cH:108][cH:109][cH:110][cH:111]2)[cH:112][cH:113]1>>[c:2]1(-[c:19]2[cH:18][cH:17][c:16]([CH3:15])[cH:21][cH:20]2)[c:3]([I:8])[cH:4][cH:5][cH:6][cH:7]1