HRID99487

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID19660

Carbonate

CO3-2

HCID24290

未命名化合物

HCID31275

1,4-Dioxane

C4H8O2

HCID4992640

5-Formylpyridine-3-boronic acid pinacol ester

C12H16BNO3

HCID22591181

4-Bromo-3-methoxybenzonitrile

C8H6BrNO

PRODUCTS

生成物

HCID59578430

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7c6a23f21c884f15b99ec1da68cb71aa
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

[Br:1][c:2]1[c:3]([O:10][CH3:11])[cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1.[C:29](=[O:30])([O-:31])[O-:32].[CH2:35]1[O:36][CH2:37][CH2:38][O:39][CH2:40]1.[CH3:12][C:13]1([CH3:14])[C:15]([CH3:16])([CH3:17])[O:18][B:19]([c:20]2[cH:21][c:22]([CH:26]=[O:27])[cH:23][n:24][cH:25]2)[O:28]1.[Na+:33].[Na+:34].[Pd:41]([Cl:42])[Cl:43].[c:44]1([P:45]([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[cH:58][cH:59][cH:60][cH:61][cH:62]1.[c:63]1([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)[cH:77][cH:78][cH:79][cH:80][cH:81]1>>[c:2]1(-[c:20]2[cH:21][c:22]([CH:26]=[O:27])[cH:23][n:24][cH:25]2)[c:3]([O:10][CH3:11])[cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1