HRID284265

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID8857

Ethyl acetate

C4H8O2

HCID11575

Benzene, iodo-

C6H5I

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID2783242

5-Bromo-2-fluoropyridine-3-boronic acid

C5H4BBrFNO2

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

HCID12033012

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4ddea4e060044d4a9aba420ad947e777
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

[Br:1][c:2]1[cH:3][c:4]([B:9]([OH:10])[OH:11])[c:5]([F:8])[n:6][cH:7]1.[C:19](=[O:20])([O-:21])[O-:22].[CH2:31]1[O:32][CH2:33][CH2:34][O:35][CH2:36]1.[CH3:25][CH2:26][O:27][C:28](=[O:29])[CH3:30].[I:12][c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1.[Na+:23].[Na+:24].[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>>[Br:1][c:2]1[cH:3][c:4](-[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[c:5]([F:8])[n:6][cH:7]1