HRID837299

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

2 次

HCID8071

未命名化合物

HCID11776

Triphenylphosphine

C18H15P

4 次

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

HCID2734615

4-Aminophenylboronic acid

C6H8BNO2

HCID21985664

未命名化合物

PRODUCTS

生成物

结构：Nc1ccc(-c2ccc(C(=O)C3CCCC3C(=O)O)cc2)cc1

HCID21985686

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-79bfb7cb3bd74c0bbd7739fae176aee1
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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