HRID677770

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

2 次

HCID8071

未命名化合物

HCID19660

Carbonate

CO3-2

HCID3814811

5-bromopyridine-3-boronic acid

C5H5BBrNO2

HCID86632429

未命名化合物

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：Cc1cccc(-c2nc(-c3cncc(Br)c3)c3cc[nH]c3n2)n1

HCID44194448

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-911c1a4b2c464581970126c64755b43c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[Br:18][c:19]1[cH:20][n:21][cH:22][c:23]([B:25]([OH:26])[OH:27])[cH:24]1.[C:28](=[O:29])([O-:30])[O-:31].[CH3:34][O:35][CH2:36][CH2:37][O:38][CH3:39].[CH3:40][CH2:41][OH:42].[I:1][c:2]1[c:3]2[c:4]([n:5][c:6](-[c:8]3[n:9][c:10]([CH3:14])[cH:11][cH:12][cH:13]3)[n:7]1)[nH:15][cH:16][cH:17]2.[Na+:32].[Na+:33].[cH:43]1[cH:44][cH:45][c:46]([P:47]([Pd:48]([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)[P:87]([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)[c:112]2[cH:113][cH:114][cH:115][cH:116][cH:117]2)[cH:118][cH:119]1>>[c:2]1(-[c:23]2[cH:22][n:21][cH:20][c:19]([Br:18])[cH:24]2)[c:3]2[c:4]([n:5][c:6](-[c:8]3[n:9][c:10]([CH3:14])[cH:11][cH:12][cH:13]3)[n:7]1)[nH:15][cH:16][cH:17]2