HRID2327978

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID828291

未命名化合物

HCID2763240

2-Fluoro-5-formylphenylboronic acid

C7H6BFO3

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：O=Cc1ccc(F)c(-c2ccc3nc(-c4ccc(Cl)cc4)cn3c2)c1

HCID86651937

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-984924156e144120b6ab71aa50aa5c83
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

[Br:1][c:2]1[cH:3][cH:4][c:5]2[n:6]([cH:7]1)[cH:8][c:9](-[c:11]1[cH:12][cH:13][c:14]([Cl:17])[cH:15][cH:16]1)[n:10]2.[F:18][c:19]1[c:20]([B:27]([OH:28])[OH:29])[cH:21][c:22]([CH:25]=[O:26])[cH:23][cH:24]1.[cH:30]1[cH:31][cH:32][c:33]([P:34]([Pd:35]([P:36]([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)[c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)([P:55]([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)[c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[P:74]([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)[c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)[cH:105][cH:106]1>>[c:2]1(-[c:20]2[c:19]([F:18])[cH:24][cH:23][c:22]([CH:25]=[O:26])[cH:21]2)[cH:3][cH:4][c:5]2[n:6]([cH:7]1)[cH:8][c:9](-[c:11]1[cH:12][cH:13][c:14]([Cl:17])[cH:15][cH:16]1)[n:10]2