HRID946096

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID81522

Benzoyl chloride, 2-chloro-4-nitro-

C7H3Cl2NO3

HCID13614033

Methyl 3-iodo-4-methylbenzoate

C9H9IO2

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

HCID178461726

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(C)c(C(=O)c2ccc([N+](=O)[O-])cc2Cl)c1

HCID67313190

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-44c6648078ea4f73b71dca4369725290
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

[CH2:18]1[O:19][CH2:20][CH2:21][CH2:22]1.[CH3:113][c:114]1[cH:115][cH:116][cH:117][cH:118][cH:119]1.[CH3:120][CH2:121][O:122][C:123]([CH3:124])=[O:125].[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([I:11])[c:7]([CH3:10])[cH:8][cH:9]1)=[O:12].[CH:14]([Mg+:15])([CH3:16])[CH3:17].[Cl-:13].[Cl:23][c:24]1[c:25]([C:26](=[O:27])[Cl:28])[cH:29][cH:30][c:31]([N+:33](=[O:34])[O-:35])[cH:32]1.[OH2:126].[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>>[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([C:26]([c:25]2[c:24]([Cl:23])[cH:32][c:31]([N+:33](=[O:34])[O-:35])[cH:30][cH:29]2)=[O:27])[c:7]([CH3:10])[cH:8][cH:9]1)=[O:12]