HRID207015

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID8071

未命名化合物

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID2783270

2-Fluoro-3-pyridylboronic acid

C5H5BFNO2

HCID59327246

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

HCID59327028

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f014624f134d467aabc2f57687cdb765
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

[CH3:31][O:32][CH2:33][CH2:34][O:35][CH3:36].[CH3:37][CH2:38][O:39][C:40]([CH3:41])=[O:42].[F:21][c:22]1[n:23][cH:24][cH:25][cH:26][c:27]1[B:28]([OH:29])[OH:30].[F:7][C:8]([F:9])([F:10])[S:11]([O:12][C:13]1=[CH:18][CH2:17][CH2:16][O:15][CH2:14]1)(=[O:19])=[O:20].[Na+:1].[Na+:2].[O-:3][C:4](=[O:5])[O-:6].[OH2:43].[cH:44]1[cH:45][cH:46][c:47]([P:48]([Pd:49]([P:50]([c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)([P:69]([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[P:88]([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)([c:107]2[cH:108][cH:109][cH:110][cH:111][cH:112]2)[c:113]2[cH:114][cH:115][cH:116][cH:117][cH:118]2)[cH:119][cH:120]1>>[C:13]1([c:27]2[c:22]([F:21])[n:23][cH:24][cH:25][cH:26]2)=[CH:18][CH2:17][CH2:16][O:15][CH2:14]1