HRID943178

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8071

未命名化合物

HCID15413

Methyl tert-butyl ether

C5H12O

HCID28179

Fluoride

F-

HCID104967

Cesium(1+)

Cs+

HCID10214807

未命名化合物

HCID23450917

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：CCCCCc1ccc(-c2ccc(OC(F)(F)F)c(F)c2C=O)cc1

HCID23450916

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-80e38f4a329f41e79ee899144e929947
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

[Br:1][c:2]1[c:3]([CH:4]=[O:5])[c:6]([F:15])[c:7]([O:10][C:11]([F:12])([F:13])[F:14])[cH:8][cH:9]1.[CH2:16]([CH2:17][CH2:18][CH2:19][CH3:20])[c:21]1[cH:22][cH:23][c:24]([O:27][B:28]([OH:29])[OH:30])[cH:25][cH:26]1.[CH2:39]([CH2:40][O:41][CH3:42])[O:43][CH3:44].[CH3:33][O:34][C:35]([CH3:36])([CH3:37])[CH3:38].[Cs+:32].[F-:31].[OH2:122].[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:2]1(-[c:24]2[cH:23][cH:22][c:21]([CH2:16][CH2:17][CH2:18][CH2:19][CH3:20])[cH:26][cH:25]2)[c:3]([CH:4]=[O:5])[c:6]([F:15])[c:7]([O:10][C:11]([F:12])([F:13])[F:14])[cH:8][cH:9]1