HRID142901

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID813

Potassium cation

K+

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID8071

未命名化合物

HCID8857

Ethyl acetate

C4H8O2

HCID11776

Triphenylphosphine

C18H15P

HCID19660

Carbonate

CO3-2

HCID28179

Fluoride

F-

HCID105144

Palladium(2+)

Pd+2

HCID2734338

3,5-Difluorophenylboronic acid

C6H5BF2O2

HCID10965245

4-bromo-2,6-dimethylpyrimidine

C6H7BrN2

PRODUCTS

生成物

HCID67164464

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bff7a51dae4e43eba446d2bd5c7cfc54
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[Br:1][c:2]1[n:3][c:4]([CH3:9])[n:5][c:6]([CH3:8])[cH:7]1.[C:54]([O-:55])(=[O:56])[CH3:57].[C:59]([O-:60])(=[O:61])[CH3:62].[C:64]([O:65][CH2:66][CH3:67])(=[O:68])[CH3:69].[CH3:48][O:49][CH2:50][CH2:51][O:52][CH3:53].[F-:21].[F:10][c:11]1[cH:12][c:13]([B:18]([OH:19])[OH:20])[cH:14][c:15]([F:17])[cH:16]1.[K+:22].[Na+:23].[Na+:24].[O-:25][C:26](=[O:27])[O-:28].[OH2:63].[Pd+2:58].[c:29]1([P:30]([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[cH:43][cH:44][cH:45][cH:46][cH:47]1>>[c:2]1(-[c:13]2[cH:12][c:11]([F:10])[cH:16][c:15]([F:17])[cH:14]2)[n:3][c:4]([CH3:9])[n:5][c:6]([CH3:8])[cH:7]1