HRID944581

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID8071

未命名化合物

HCID19660

Carbonate

CO3-2

HCID2763081

(6-Methylpyridin-3-yl)boronic acid

C6H8BNO2

HCID2782166

Methyl 5,6-Dichloronicotinate

C7H5Cl2NO2

反应SMILES：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

产物

反应SMILES：COC(=O)c1cnc(-c2ccc(C)nc2)c(Cl)c1

HCID57825687

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-9ab8e58da6e04201b017c02e49974d7c
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应SMILES

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