HRID1543232

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

HCID813

Potassium cation

K+

HCID887

Methanol

CH4O

HCID6212

Chloroform

CHCl3

HCID6344

Dichloromethane

CH2Cl2

HCID8058

n-Hexane

C6H14

HCID12547675

2-Methyl-1,3-oxazole

C4H5NO

HCID86618028

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

结构：COc1ccc(-c2cc(-c3cnc(C)o3)n3nc(N)nc3c2)cn1

HCID68835987

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-88d6e465677f473fb7f8da033b1bb7e2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH3:20][c:21]1[o:22][cH:23][cH:24][n:25]1.[CH3:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39].[CH3:40][OH:41].[Cl:1][c:2]1[cH:3][c:4](-[c:12]2[cH:13][n:14][c:15]([O:18][CH3:19])[cH:16][cH:17]2)[cH:5][c:6]2[n:7]1[n:8][c:9]([NH2:11])[n:10]2.[Cl:31][CH2:32][Cl:33].[Cl:42][CH:43]([Cl:44])[Cl:45].[K+:30].[O-:26][C:27]([CH3:28])=[O:29].[cH:46]1[cH:47][cH:48][c:49]([P:50]([Pd:51]([P:52]([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)([P:71]([c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)[c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[P:90]([c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)([c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)[c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)([c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)[c:115]2[cH:116][cH:117][cH:118][cH:119][cH:120]2)[cH:121][cH:122]1>>[c:2]1(-[c:23]2[o:22][c:21]([CH3:20])[n:25][cH:24]2)[cH:3][c:4](-[c:12]2[cH:13][n:14][c:15]([O:18][CH3:19])[cH:16][cH:17]2)[cH:5][c:6]2[n:7]1[n:8][c:9]([NH2:11])[n:10]2