HRID822060

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID962

Water

H2O

2 次

HCID1140

Toluene

C7H8

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID78345

Pyrimidine, 2-bromo-

C4H3BrN2

HCID104967

Cesium(1+)

Cs+

2 次

HCID2762706

2-Bromopyridine-5-boronic acid

C5H5BBrNO2

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

HCID53486981

2-(6-Bromopyridin-3-yl)pyrimidine

C9H6BrN3

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5e6bdc26cc31421387af75a22ea8abb6
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:1][c:2]1[n:3][cH:4][cH:5][cH:6][n:7]1.[Br:8][c:9]1[n:10][cH:11][c:12]([B:15]([OH:16])[OH:17])[cH:13][cH:14]1.[C:18](=[O:19])([O-:20])[O-:21].[CH3:24][OH:25].[CH3:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[CH3:34][CH2:35][O:36][C:37]([CH3:38])=[O:39].[Cs+:22].[Cs+:23].[OH2:33].[OH2:40].[cH:41]1[cH:42][cH:43][c:44]([P:45]([Pd:46]([P:47]([c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)([c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)([P:66]([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)([c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)[P:85]([c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)([c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)[c:98]2[cH:99][cH:100][cH:101][cH:102][cH:103]2)([c:104]2[cH:105][cH:106][cH:107][cH:108][cH:109]2)[c:110]2[cH:111][cH:112][cH:113][cH:114][cH:115]2)[cH:116][cH:117]1>>[c:2]1(-[c:12]2[cH:11][n:10][c:9]([Br:8])[cH:14][cH:13]2)[n:3][cH:4][cH:5][cH:6][n:7]1