HRID669670

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID104967

Cesium(1+)

Cs+

2 次

HCID105144

Palladium(2+)

Pd+2

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

HCID53400965

2,5-Dichloro-4-iodopyridine

C5H2Cl2IN

HCID67075766

未命名化合物

PRODUCTS

生成物

HCID86655136

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d1ffb95878394656be396e7866dee1d7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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