HRID1561025

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID8071

未命名化合物

HCID19660

Carbonate Ion

CO3-2

HCID74299

Benzeneboronic acid, p-chloro-

C6H6BClO2

HCID21865140

5-Bromo-2-chloro-4-iodopyridine

C5H2BrClIN

HCID178420554

未命名化合物

PRODUCTS

产物

HCID57979737

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-e1323473d6124808840114ffbc291363
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应SMILES

[Br:1][c:2]1[c:3]([I:9])[cH:4][c:5]([Cl:8])[n:6][cH:7]1.[CH3:26][O:27][CH2:28][CH2:29][O:30][CH3:31].[Cl:10][c:11]1[cH:12][cH:13][c:14]([B:17]([OH:18])[OH:19])[cH:15][cH:16]1.[K+:20].[K+:21].[O-:22][C:23]([O-:24])=[O:25].[OH2:32].[cH:33]1[cH:34][cH:35][c:36]([P:37]([Pd:38]([P:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)([P:58]([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)([c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)[P:77]([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)([c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)[c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)[cH:108][cH:109]1>>[Br:1][c:2]1[c:3](-[c:14]2[cH:13][cH:12][c:11]([Cl:10])[cH:16][cH:15]2)[cH:4][c:5]([Cl:8])[n:6][cH:7]1