HRID311641

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID222

Ammonia gas

H3N

HCID312

Chloride

Cl-

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

2 次

HCID1140

Toluene

C7H8

HCID19660

Carbonate

CO3-2

HCID28486

Lithium ion

Li+

HCID2734357

2-Furanboronic acid

C4H5BO3

结构：CCCN(CCC)C1COc2c(F)ccc(S(=O)(=O)C(F)(F)F)c2C1

HCID19028187

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

HCID19028136

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5467cfc0584b484682fc27d1543aef48
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH2:1]([CH2:2][CH3:3])[N:4]([CH:5]1[CH2:6][O:7][c:8]2[c:9]([F:22])[cH:10][cH:11][c:12]([S:15]([C:16]([F:17])([F:18])[F:19])(=[O:20])=[O:21])[c:13]2[CH2:14]1)[CH2:23][CH2:24][CH3:25].[CH3:120][CH2:121][OH:122].[CH3:123][c:124]1[cH:125][cH:126][cH:127][cH:128][cH:129]1.[Cl-:35].[Li+:34].[NH3:42].[Na+:36].[Na+:37].[O-:38][C:39](=[O:40])[O-:41].[cH:43]1[cH:44][cH:45][c:46]([P:47]([Pd:48]([P:49]([c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)([c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)([P:68]([c:69]2[cH:70][cH:71][cH:72][cH:73][cH:74]2)([c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)[c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)[P:87]([c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)([c:94]2[cH:95][cH:96][cH:97][cH:98][cH:99]2)[c:100]2[cH:101][cH:102][cH:103][cH:104][cH:105]2)([c:106]2[cH:107][cH:108][cH:109][cH:110][cH:111]2)[c:112]2[cH:113][cH:114][cH:115][cH:116][cH:117]2)[cH:118][cH:119]1.[o:26]1[c:27]([B:31]([OH:32])[OH:33])[cH:28][cH:29][cH:30]1>>[CH2:1]([CH2:2][CH3:3])[N:4]([CH:5]1[CH2:6][O:7][c:8]2[c:9]([F:22])[cH:10][cH:11][c:12](-[c:27]3[o:26][cH:30][cH:29][cH:28]3)[c:13]2[CH2:14]1)[CH2:23][CH2:24][CH3:25]