HRID799313

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID8857

Ethyl acetate

C4H8O2

HCID14268

4-Bromopyridine

C5H4BrN

HCID19660

Carbonate

CO3-2

HCID22709991

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

HCID313

Hydrochloric Acid

ClH

HCID1520811

4-PYRIDIN-4-YL-BENZOIC ACID

C12H9NO2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-969ed8b2aeb54ec49b0eecf490228446
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[Br:2][c:3]1[cH:4][cH:5][n:6][cH:7][cH:8]1.[C:9](=[O:10])([OH:11])[c:12]1[cH:13][cH:14][c:15]([O:18][B:19]([OH:20])[OH:21])[cH:16][cH:17]1.[CH3:28][CH2:29][O:30][C:31](=[O:32])[CH3:33].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[ClH:1].[Na+:22].[Na+:23].[O-:24][C:25](=[O:26])[O-:27].[OH2:41].[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>>[ClH:1].[c:3]1(-[c:15]2[cH:14][cH:13][c:12]([C:9](=[O:10])[OH:11])[cH:17][cH:16]2)[cH:4][cH:5][n:6][cH:7][cH:8]1