HRID159499

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID8071

未命名化合物

HCID19660

Carbonate

CO3-2

结构：Brc1ccc(-n2c(-c3ccccc3)nc3ccccc32)cc1

HCID23094071

1-(4-Bromophenyl)-2-phenyl-1H-benzimidazole

C19H13BrN2

结构：OB(O)c1ccc2c(-c3ccccc3)c3ccccc3c(-c3ccccc3)c2c1

HCID23160215

(9,10-Diphenylanthracen-2-yl)boronic acid

C26H19BO2

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：c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4ccc(-n5c(-c6ccccc6)nc6ccccc65)cc4)ccc23)cc1

HCID58953815

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e881dce295b24d0faf6cd22409775ad8
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:1][c:2]1[cH:3][cH:4][c:5](-[n:8]2[c:9](-[c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[n:10][c:11]3[c:12]2[cH:13][cH:14][cH:15][cH:16]3)[cH:6][cH:7]1.[CH3:135][O:136][CH2:137][CH2:138][O:139][CH3:140].[Na+:52].[Na+:53].[O-:54][C:55](=[O:56])[O-:57].[c:23]1(-[c:29]2[c:30]3[cH:31][cH:32][cH:33][cH:34][c:35]3[c:36](-[c:46]3[cH:47][cH:48][cH:49][cH:50][cH:51]3)[c:37]3[cH:38][cH:39][c:40]([B:43]([OH:44])[OH:45])[cH:41][c:42]23)[cH:24][cH:25][cH:26][cH:27][cH:28]1.[cH:58]1[cH:59][cH:60][c:61]([P:62]([Pd:63]([P:64]([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)[c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)([P:83]([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)[P:102]([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)[c:127]2[cH:128][cH:129][cH:130][cH:131][cH:132]2)[cH:133][cH:134]1>>[c:2]1(-[c:40]2[cH:39][cH:38][c:37]3[c:36](-[c:46]4[cH:47][cH:48][cH:49][cH:50][cH:51]4)[c:35]4[c:30]([c:29](-[c:23]5[cH:24][cH:25][cH:26][cH:27][cH:28]5)[c:42]3[cH:41]2)[cH:31][cH:32][cH:33][cH:34]4)[cH:3][cH:4][c:5](-[n:8]2[c:9](-[c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[n:10][c:11]3[c:12]2[cH:13][cH:14][cH:15][cH:16]3)[cH:6][cH:7]1