HRID123545

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID1140

Toluene

C7H8

HCID19660

Carbonate

CO3-2

HCID2773548

Boronic acid, B-(2-nitrophenyl)-

C6H6BNO4

HCID13411668

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

HCID23142003

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-331432d5b6d844c797b4b319a393be9f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:13][C:14]1([CH3:28])[CH2:15][CH:16]=[C:17]([O:20][S:21]([C:22]([F:23])([F:24])[F:25])(=[O:26])=[O:27])[CH2:18][CH2:19]1.[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([B:10]([OH:11])[OH:12])[cH:6][cH:7][cH:8][cH:9]1.[Na+:29].[Na+:30].[O-:31][C:32](=[O:33])[O-:34].[cH:42]1[cH:43][cH:44][c:45]([P:46]([Pd:47]([P:48]([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)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)([P:67]([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)[c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)[P:86]([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)[c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)[cH:117][cH:118]1>>[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([C:17]2=[CH:16][CH2:15][C:14]([CH3:13])([CH3:28])[CH2:19][CH2:18]2)[cH:6][cH:7][cH:8][cH:9]1