HRID158520

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID104967

Cesium(1+)

Cs+

2 次

HCID105144

Palladium(2+)

Pd+2

HCID308072

2-Amino-N-methylbenzamide

C8H10N2O

结构：CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21

HCID636044

1,1'-(9,9-Dimethyl-9H-xanthene-4,5-diyl)bis(1,1-diphenylphosphine)

C39H32OP2

HCID24820495

2-Chloro-5-fluoro-4-iodopyridine

C5H2ClFIN

PRODUCTS

生成物

HCID59620135

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3825e284bb804c7dbc40cd98c160a32e
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

[C:1](=[O:2])([O-:3])[O-:4].[CH3:27][C:28]1([CH3:29])[c:30]2[cH:31][cH:32][cH:33][c:34]([P:35]([c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[c:42]3[cH:43][cH:44][cH:45][cH:46][cH:47]3)[c:48]2[O:49][c:50]2[c:51]1[cH:52][cH:53][cH:54][c:55]2[P:56]([c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1)[c:63]1[cH:64][cH:65][cH:66][cH:67][cH:68]1.[Cl:18][c:19]1[n:20][cH:21][c:22]([F:26])[c:23]([I:25])[cH:24]1.[Cl:75][CH2:76][Cl:77].[Cs+:5].[Cs+:6].[NH2:7][c:8]1[c:9]([C:10](=[O:11])[NH:12][CH3:13])[cH:14][cH:15][cH:16][cH:17]1.[O-:79][C:80]([CH3:81])=[O:82].[O-:83][C:84]([CH3:85])=[O:86].[O:69]1[CH2:70][CH2:71][O:72][CH2:73][CH2:74]1.[Pd+2:78]>>[NH:7]([c:8]1[c:9]([C:10](=[O:11])[NH:12][CH3:13])[cH:14][cH:15][cH:16][cH:17]1)[c:23]1[c:22]([F:26])[cH:21][n:20][c:19]([Cl:18])[cH:24]1