HRID2325672

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

HCID19660

Carbonate

CO3-2

HCID11587208

1-(Oxan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

C14H23BN2O3

HCID13732745

2-Bromo-1,3-difluoro-4-nitrobenzene

C6H2BrF2NO2

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：O=[N+]([O-])c1ccc(F)c(-c2ccnn2C2CCCCO2)c1F

HCID67185084

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a676e7f082e84a92a278db398447411c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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