HRID121411

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6417

2,2-Dimethylpropanoic acid

C5H10O2

HCID19660

Carbonate Ion

CO3-2

HCID105144

Palladium(2+)

Pd+2

HCID140387

Phosphine, tris(4-fluorophenyl)-

C18H12F3P

HCID6919101

Pivalate anion

C5H9O2-

2 次

HCID69673179

未命名化合物

PRODUCTS

产物

HCID86688332

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-27008c35b0054ed0b491b3f687549b6e
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:36][c:37]1[c:38]([CH2:39][O:40][c:41]2[c:42]3[c:47]([cH:48][cH:49][cH:50]2)[C:46](=[O:51])[CH2:45][CH2:44][CH2:43]3)[cH:52][c:53]([Cl:56])[cH:54][cH:55]1.[C:30](=[O:31])([O-:32])[O-:33].[C:57]([O-:58])(=[O:59])[C:60]([CH3:61])([CH3:62])[CH3:63].[C:65]([O-:66])(=[O:67])[C:68]([CH3:69])([CH3:70])[CH3:71].[CH3:23][C:24]([C:25](=[O:26])[OH:27])([CH3:28])[CH3:29].[F:1][c:2]1[cH:3][cH:4][c:5]([P:6]([c:7]2[cH:8][cH:9][c:10]([F:11])[cH:12][cH:13]2)[c:14]2[cH:15][cH:16][c:17]([F:18])[cH:19][cH:20]2)[cH:21][cH:22]1.[K+:34].[K+:35].[Pd+2:64]>>[c:37]12[c:38]([cH:52][c:53]([Cl:56])[cH:54][cH:55]1)[CH2:39][O:40][c:41]1[c:42]3[c:47]([cH:48][cH:49][c:50]1-2)[C:46](=[O:51])[CH2:45][CH2:44][CH2:43]3