HRID1238177

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID1140

Toluene

C7H8

HCID6115

Aniline

C6H7N

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID105144

Palladium(2+)

Pd+2

结构：c1ccc(P(c2ccccc2)c2ccc3ccccc3c2-c2c(P(c3ccccc3)c3ccccc3)ccc3ccccc23)cc1

HCID634876

2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl

C44H32P2

HCID7210837

methyl 2-bromo-4-fluorobenzoate

C8H6BrFO2

PRODUCTS

生成物

HCID67227354

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fe5713c606dd492a928d8ce59e974775
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[Br:1][c:2]1[c:3]([C:4](=[O:5])[O:6][CH3:7])[cH:8][cH:9][c:10]([F:12])[cH:11]1.[C:66](=[O:67])([O-:68])[O-:69].[CH3:72][c:73]1[cH:74][cH:75][cH:76][cH:77][cH:78]1.[Cs+:70].[Cs+:71].[NH2:13][c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1.[O-:80][C:81]([CH3:82])=[O:83].[O-:84][C:85]([CH3:86])=[O:87].[Pd+2:79].[c:20]1([P:21]([c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:28]2[cH:29][cH:30][c:31]3[c:32]([cH:33][cH:34][cH:35][cH:36]3)[c:37]2-[c:38]2[c:39]3[c:40]([cH:41][cH:42][cH:43][cH:44]3)[cH:45][cH:46][c:47]2[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)[cH:61][cH:62][cH:63][cH:64][cH:65]1>>[c:2]1([NH:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[c:3]([C:4](=[O:5])[O:6][CH3:7])[cH:8][cH:9][c:10]([F:12])[cH:11]1