HRID167235

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID19660

Carbonate

CO3-2

HCID5003684

1-Phenylvinylboronic acid

C8H9BO2

结构：C[Si](C)(C)CCOCn1ccc2c(-n3cc(Br)cn3)ccnc21

HCID57477673

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：C=C(c1ccccc1)c1cnn(-c2ccnc3c2ccn3COCC[Si](C)(C)C)c1

HCID57477674

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4c3f99d33d6e4ea2b33b16abecfc42dd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[Br:12][c:13]1[cH:14][n:15][n:16](-[c:18]2[c:19]3[c:20]([n:21][cH:22][cH:23]2)[n:24]([CH2:27][O:28][CH2:29][CH2:30][Si:31]([CH3:32])([CH3:33])[CH3:34])[cH:25][cH:26]3)[cH:17]1.[C:45](=[O:46])([O-:47])[O-:48].[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[CH3:42][CH2:43][OH:44].[K+:49].[K+:50].[OH2:51].[c:1]1([C:7](=[CH2:8])[B:9]([OH:10])[OH:11])[cH:2][cH:3][cH:4][cH:5][cH:6]1.[cH:52]1[cH:53][cH:54][c:55]([P:56]([Pd:57]([P:58]([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)[c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([P:77]([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)[c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)[P:96]([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)[c:121]2[cH:122][cH:123][cH:124][cH:125][cH:126]2)[cH:127][cH:128]1>>[c:1]1([C:7](=[CH2:8])[c:13]2[cH:14][n:15][n:16](-[c:18]3[c:19]4[c:20]([n:21][cH:22][cH:23]3)[n:24]([CH2:27][O:28][CH2:29][CH2:30][Si:31]([CH3:32])([CH3:33])[CH3:34])[cH:25][cH:26]4)[cH:17]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1