HRID2342026

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

2 次

HCID313

Hydrochloric Acid

ClH

HCID8028

Tetrahydrofuran

C4H8O

HCID8078

Cyclohexane

C6H12

HCID32051

Zinc (II) cation

Zn+2

HCID170481

4-Iodo-2-nitrotoluene

C7H6INO2

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

HCID178506676

未命名化合物

PRODUCTS

生成物

HCID12909826

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2d77fd7be6534db195223cb3cf848f71
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH2:25]1[O:26][CH2:27][CH2:28][CH2:29]1.[CH2:8]1[CH2:9][CH2:10][CH2:11][CH2:12][CH2:13]1.[Cl-:31].[Cl-:33].[ClH:30].[I:14][c:15]1[cH:16][c:17]([N+:22](=[O:23])[O-:24])[c:18]([CH3:21])[cH:19][cH:20]1.[Li:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1.[Zn+2:32].[cH:34]1[cH:35][cH:36][c:37]([P:38]([Pd:39]([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)[c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)([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)[c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)[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)[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)[cH:109][cH:110]1>>[c:2]1(-[c:15]2[cH:16][c:17]([N+:22](=[O:23])[O-:24])[c:18]([CH3:21])[cH:19][cH:20]2)[cH:3][cH:4][cH:5][cH:6][cH:7]1