HRID104113

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID8071

未命名化合物

HCID19660

Carbonate

CO3-2

HCID30591

4-Chloro-6-methyl-1,3,5-triazin-2-amine

C4H5ClN4

HCID2763126

2-CHLORO-5-METHYLPYRIDINE-3-BORONIC ACID

C6H7BClNO2

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

HCID59548241

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-56ce8d019f7d411c932fe76f7837157a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:27][O:28][CH2:29][CH2:30][O:31][CH3:32].[Cl:10][c:11]1[n:12][cH:13][c:14]([CH3:20])[cH:15][c:16]1[B:17]([OH:18])[OH:19].[Cl:1][c:2]1[n:3][c:4]([NH2:9])[n:5][c:6]([CH3:8])[n:7]1.[Na+:21].[Na+:22].[O-:23][C:24](=[O:25])[O-:26].[OH2:33].[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:16]2[c:11]([Cl:10])[n:12][cH:13][c:14]([CH3:20])[cH:15]2)[n:3][c:4]([NH2:9])[n:5][c:6]([CH3:8])[n:7]1