HRID2318846

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID2734335

2,5-Difluorophenylboronic acid

C6H5BF2O2

结构：COC(=O)c1ccc(OS(=O)(=O)C(F)(F)F)c(C(=O)OC)c1

HCID12017546

4-[[(Trifluoromethyl)sulfonyl]oxy]-1,3-benzenedicarboxylic acid dimethyl ester

C11H9F3O7S

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：COC(=O)c1ccc(-c2cc(F)ccc2F)c(C(=O)OC)c1

HCID57707138

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e35bf8585f5947548680996b303effcc
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[C:34](=[O:35])([O-:36])[O-:37].[F:1][C:2]([F:3])([F:4])[S:5]([O:6][c:7]1[c:8]([C:17](=[O:18])[O:19][CH3:20])[cH:9][c:10]([C:11](=[O:12])[O:13][CH3:14])[cH:15][cH:16]1)(=[O:21])=[O:22].[F:23][c:24]1[c:25]([B:31]([OH:32])[OH:33])[cH:26][c:27]([F:30])[cH:28][cH:29]1.[K+:38].[K+:39].[O:40]=[CH:41][N:42]([CH3:43])[CH3:44].[cH:45]1[cH:46][cH:47][c:48]([P:49]([Pd:50]([P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)([P:70]([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[P:89]([c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)[c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)[c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[cH:120][cH:121]1>>[c:7]1(-[c:25]2[c:24]([F:23])[cH:29][cH:28][c:27]([F:30])[cH:26]2)[c:8]([C:17](=[O:18])[O:19][CH3:20])[cH:9][c:10]([C:11](=[O:12])[O:13][CH3:14])[cH:15][cH:16]1