HRID95314

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID11776

Triphenylphosphine

C18H15P

4 次

HCID19660

Carbonate Ion

CO3-2

HCID23938

Palladium

HCID31275

1,4-Dioxane

C4H8O2

HCID1415868

3-bromopyridine-2,6-diamine

C5H6BrN3

HCID2734661

2,3-Dichlorophenylboronic acid

C6H5BCl2O2

PRODUCTS

产物

HCID57582357

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-6178587d53ca40efb9caa05414df2e0f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

[Br:1][c:2]1[c:3]([NH2:9])[n:4][c:5]([NH2:8])[cH:6][cH:7]1.[C:21](=[O:22])([O-:23])[O-:24].[CH2:27]1[O:28][CH2:29][CH2:30][O:31][CH2:32]1.[Cl:10][c:11]1[c:12]([B:18]([OH:19])[OH:20])[cH:13][cH:14][cH:15][c:16]1[Cl:17].[K+:25].[K+:26].[OH2:33].[Pd:110].[c:34]1([P:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:48][cH:49][cH:50][cH:51][cH:52]1.[c:53]1([P:54]([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)[cH:67][cH:68][cH:69][cH:70][cH:71]1.[c:72]1([P:73]([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)[cH:86][cH:87][cH:88][cH:89][cH:90]1.[c:91]1([P:92]([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)[cH:105][cH:106][cH:107][cH:108][cH:109]1>>[c:2]1(-[c:12]2[c:11]([Cl:10])[c:16]([Cl:17])[cH:15][cH:14][cH:13]2)[c:3]([NH2:9])[n:4][c:5]([NH2:8])[cH:6][cH:7]1