HRID934299

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

2 次

HCID313

Hydrochloric Acid

ClH

HCID8028

Tetrahydrofuran

C4H8O

HCID32051

Zinc (II) cation

Zn+2

HCID142891

Ethyl 4-iodobenzoate

C9H9IO2

HCID12168056

2-[4-(Trifluoromethyl)phenyl]thiophene

C11H7F3S

HCID178418339

Butyllithium

C4H9Li

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)c1ccc(-c2ccc(-c3ccc(C(F)(F)F)cc3)s2)cc1

HCID22934543

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ffa57c497a2a4f9f93d2d3258c376b72
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

[CH2:16]([Li:17])[CH2:18][CH2:19][CH3:20].[Cl-:39].[Cl-:41].[ClH:33].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[s:10][cH:11][cH:12][cH:13]2)[cH:7][cH:8]1)([F:14])[F:15].[I:21][c:22]1[cH:23][cH:24][c:25]([C:26](=[O:27])[O:28][CH2:29][CH3:30])[cH:31][cH:32]1.[O:34]1[CH2:35][CH2:36][CH2:37][CH2:38]1.[Zn+2:40].[cH:42]1[cH:43][cH:44][c:45]([P:46]([Pd:47]([P:48]([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)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)([P:67]([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)[c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)[P:86]([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)[c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)[cH:117][cH:118]1>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[s:10][c:11](-[c:22]3[cH:23][cH:24][c:25]([C:26](=[O:27])[O:28][CH2:29][CH3:30])[cH:31][cH:32]3)[cH:12][cH:13]2)[cH:7][cH:8]1)([F:14])[F:15]