HRID948584

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID5975

Cyanide

CN-

HCID8028

Tetrahydrofuran

C4H8O

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

结构：CCOC(=O)C1=Cc2cc(OC(F)(F)F)cc(I)c2OC1C(F)(F)F

HCID86599457

未命名化合物

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420554

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C1=Cc2cc(OC(F)(F)F)cc(C#N)c2OC1C(F)(F)F

HCID86599465

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5d2ed5cccaa14cab9a33288e932b5612
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C-:26]#[N:27].[CH2:29]1[O:30][CH2:31][CH2:32][CH2:33]1.[Cu:34][I:35].[I:1][c:2]1[cH:3][c:4]([O:21][C:22]([F:23])([F:24])[F:25])[cH:5][c:6]2[c:11]1[O:10][CH:9]([C:12]([F:13])([F:14])[F:15])[C:8]([C:16](=[O:17])[O:18][CH2:19][CH3:20])=[CH:7]2.[K+:28].[cH:36]1[cH:37][cH:38][c:39]([P:40]([Pd:41]([P:42]([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)([P:61]([c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)([c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)[P:80]([c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)([c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)[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)[c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)[cH:111][cH:112]1>>[c:2]1([C:26]#[N:27])[cH:3][c:4]([O:21][C:22]([F:23])([F:24])[F:25])[cH:5][c:6]2[c:11]1[O:10][CH:9]([C:12]([F:13])([F:14])[F:15])[C:8]([C:16](=[O:17])[O:18][CH2:19][CH3:20])=[CH:7]2