HRID799815

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

3 次

HCID1061

Phosphate

O4P-3

HCID285645

4-Fluorophenylboronic acid

C6H6BFO2

结构：CC(C)c1cc2c(c(OS(=O)(=O)C(F)(F)F)c1C=O)C(=O)CC1(CCC1)O2

HCID58002941

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：CC(C)c1cc2c(c(-c3ccc(F)cc3)c1C=O)C(=O)CC1(CCC1)O2

HCID58003041

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-18297509c03f473ab1029036fcd2dec1
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[F:1][C:2]([F:3])([F:4])[S:5]([O:6][c:7]1[c:8]2[c:13]([cH:14][c:15]([CH:19]([CH3:20])[CH3:21])[c:16]1[CH:17]=[O:18])[O:12][C:11]1([CH2:10][C:9]2=[O:25])[CH2:22][CH2:23][CH2:24]1)(=[O:26])=[O:27].[F:28][c:29]1[cH:30][cH:31][c:32]([B:35]([OH:36])[OH:37])[cH:33][cH:34]1.[K+:43].[K+:44].[K+:45].[P:38]([O-:39])([O-:40])([O-:41])=[O:42].[cH:46]1[cH:47][cH:48][c:49]([P:50]([Pd:51]([P:52]([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)([P:71]([c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)[c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[P:90]([c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)([c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)[c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)([c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)[c:115]2[cH:116][cH:117][cH:118][cH:119][cH:120]2)[cH:121][cH:122]1>>[c:7]1(-[c:32]2[cH:31][cH:30][c:29]([F:28])[cH:34][cH:33]2)[c:8]2[c:13]([cH:14][c:15]([CH:19]([CH3:20])[CH3:21])[c:16]1[CH:17]=[O:18])[O:12][C:11]1([CH2:10][C:9]2=[O:25])[CH2:22][CH2:23][CH2:24]1