HRID213009

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID8071

未命名化合物

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID2773485

2-Methoxy-5-methylphenylboronic acid

C8H11BO3

结构：CC1(C)C=C(OS(=O)(=O)C(F)(F)F)CC(C)(C)C1

HCID11087380

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

HCID23142676

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-02e65a8d713c4f6aad7db77083dde29a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH3:120][CH2:121][O:122][C:123](=[O:124])[CH3:125].[CH3:13][C:14]1([CH3:30])[CH:15]=[C:16]([O:22][S:23]([C:24]([F:25])([F:26])[F:27])(=[O:28])=[O:29])[CH2:17][C:18]([CH3:20])([CH3:21])[CH2:19]1.[CH3:1][O:2][c:3]1[c:4]([B:10]([OH:11])[OH:12])[cH:5][c:6]([CH3:9])[cH:7][cH:8]1.[CH3:31][O:32][CH2:33][CH2:34][O:35][CH3:36].[Na+:37].[Na+:38].[O-:39][C:40](=[O:41])[O-:42].[cH:43]1[cH:44][cH:45][c:46]([P:47]([Pd:48]([P:49]([c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)([c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)([P:68]([c:69]2[cH:70][cH:71][cH:72][cH:73][cH:74]2)([c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)[c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)[P:87]([c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)([c:94]2[cH:95][cH:96][cH:97][cH:98][cH:99]2)[c:100]2[cH:101][cH:102][cH:103][cH:104][cH:105]2)([c:106]2[cH:107][cH:108][cH:109][cH:110][cH:111]2)[c:112]2[cH:113][cH:114][cH:115][cH:116][cH:117]2)[cH:118][cH:119]1>>[CH3:1][O:2][c:3]1[c:4]([C:16]2=[CH:15][C:14]([CH3:13])([CH3:30])[CH2:19][C:18]([CH3:20])([CH3:21])[CH2:17]2)[cH:5][c:6]([CH3:9])[cH:7][cH:8]1