HRID2158305

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID1140

Toluene

C7H8

HCID19660

Carbonate

CO3-2

HCID2734347

2,5-Dimethylphenylboronic acid

C8H11BO2

反应SMILES：CCc1nc(-c2ccc(OC)cc2OC)c(CC)nc1Cl

HCID22248864

未命名化合物

反应SMILES：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

产物

反应SMILES：CCc1nc(-c2ccc(OC)cc2OC)c(CC)nc1-c1cc(C)ccc1C

HCID9969788

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-6e565fba829e4aecb233bc600adcd1cc
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应SMILES

[C:33](=[O:34])([O-:35])[O-:36].[CH3:116][c:117]1[cH:118][cH:119][cH:120][cH:121][cH:122]1.[CH3:22][c:23]1[c:24]([B:30]([OH:31])[OH:32])[cH:25][c:26]([CH3:29])[cH:27][cH:28]1.[Cl:1][c:2]1[n:3][c:4]([CH2:20][CH3:21])[c:5](-[c:10]2[c:11]([O:18][CH3:19])[cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]2)[n:6][c:7]1[CH2:8][CH3:9].[K+:37].[K+:38].[cH:39]1[cH:40][cH:41][c:42]([P:43]([Pd:44]([P:45]([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)([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)([P:64]([c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)([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)[P:83]([c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)([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)[cH:114][cH:115]1>>[c:2]1(-[c:24]2[c:23]([CH3:22])[cH:28][cH:27][c:26]([CH3:29])[cH:25]2)[n:3][c:4]([CH2:20][CH3:21])[c:5](-[c:10]2[c:11]([O:18][CH3:19])[cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]2)[n:6][c:7]1[CH2:8][CH3:9]