HRID114198

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

4 次

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

HCID2763300

未命名化合物

HCID21099404

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(S(=O)(=O)c2ccccc2C(C)O)ccc1C=Cc1ccc(F)cc1

HCID178429731

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-62cf56d69fcb4402a51f3b9eddaf3e80
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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