HRID1139660

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID6342

Acetonitrile

C2H3N

HCID19660

Carbonate

CO3-2

HCID623430

6-Bromo-2-phenylimidazo[1,2-a]pyridine

C13H9BrN2

HCID2734706

4-(Hydroxymethyl)phenylboronic acid

C7H9BO3

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：OCc1ccc(-c2ccc3nc(-c4ccccc4)cn3c2)cc1

HCID24855995

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8b4b59cb909c449ea2fa5ba899b56576
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[Br:1][c:2]1[cH:3][cH:4][c:5]2[n:6]([cH:7]1)[cH:8][c:9](-[c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)[n:10]2.[CH3:111][C:112]#[N:113].[Na+:28].[Na+:29].[O-:30][C:31](=[O:32])[O-:33].[OH:17][CH2:18][c:19]1[cH:20][cH:21][c:22]([B:25]([OH:26])[OH:27])[cH:23][cH:24]1.[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:22]2[cH:21][cH:20][c:19]([CH2:18][OH:17])[cH:24][cH:23]2)[cH:3][cH:4][c:5]2[n:6]([cH:7]1)[cH:8][c:9](-[c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)[n:10]2