HRID306417

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8071

未命名化合物

HCID292184

2,4,6-Trimethylphenylboronic acid

C9H13BO2

HCID768483

8-Bromo-4-chloro-2-methylquinoline

C10H7BrClN

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

结构：Cc1cc(C)c(-c2cccc3c(Cl)cc(C)nc23)c(C)c1

HCID22504352

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-befd84c2da9a4e56b15c41196d172b89
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH2:29]([CH2:30][O:31][CH3:32])[O:33][CH3:34].[CH3:14][c:15]1[c:16]([B:23]([OH:24])[OH:25])[c:17]([CH3:22])[cH:18][c:19]([CH3:21])[cH:20]1.[CH3:1][c:2]1[n:3][c:4]2[c:5]([Br:13])[cH:6][cH:7][cH:8][c:9]2[c:10]([Cl:12])[cH:11]1.[Cl:26][CH2:27][Cl:28].[OH2:35].[cH:36]1[cH:37][cH:38][c:39]([P:40]([Pd:41]([P:42]([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)([P:61]([c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)([c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)[P:80]([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)([c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)[c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)[cH:111][cH:112]1>>[CH3:1][c:2]1[n:3][c:4]2[c:5](-[c:16]3[c:15]([CH3:14])[cH:20][c:19]([CH3:21])[cH:18][c:17]3[CH3:22])[cH:6][cH:7][cH:8][c:9]2[c:10]([Cl:12])[cH:11]1