HRID683644

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8021

Diethylamine

C4H11N

HCID11457

Benzene, 1-bromo-3-nitro-

C6H4BrNO2

HCID30165

Iodide ion

I-

HCID66111

Trimethylsilylacetylene

C5H10Si

HCID18925084

3-(Prop-1-yn-1-yl)aniline

C9H9N

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

HCID11470040

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6ac6ee84d9584567903adec8ee13cc7d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[Br:11][c:12]1[cH:13][c:14]([N+:18](=[O:19])[O-:20])[cH:15][cH:16][cH:17]1.[C:1]([c:2]1[cH:3][c:4]([NH2:8])[cH:5][cH:6][cH:7]1)#[C:9][CH3:10].[CH2:28]([NH:29][CH2:30][CH3:31])[CH3:32].[CH3:21][Si:22]([CH3:23])([CH3:24])[C:25]#[CH:26].[I-:27].[cH:33]1[cH:34][cH:35][c:36]([P:37]([Pd:38]([P:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)([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)([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)([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)[cH:108][cH:109]1>>[c:12]1([C:26]#[C:25][Si:22]([CH3:21])([CH3:23])[CH3:24])[cH:13][c:14]([N+:18](=[O:19])[O-:20])[cH:15][cH:16][cH:17]1