HRID143440

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID813

Potassium cation

K+

HCID7977

2-Chloropyridine

C5H4ClN

HCID8028

Tetrahydrofuran

C4H8O

结构：c1ccc([B-](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID8934

Borate(1-), tetraphenyl-

C24H20B-

HCID28179

Fluoride

F-

HCID105144

Palladium(2+)

Pd+2

HCID2733267

2-Methylphenylboronic acid

C7H9BO2

HCID4060964

未命名化合物

PRODUCTS

生成物

HCID82510

2-(o-Tolyl)pyridine

C12H11N

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a782cbfff3774a5f981f350517e8070f
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

[C:45]([PH+:46]([C:47]([CH3:48])([CH3:49])[CH3:50])[C:51]([CH3:52])([CH3:53])[CH3:54])([CH3:55])([CH3:56])[CH3:57].[Cl:1][c:2]1[cH:3][cH:4][cH:5][cH:6][n:7]1.[F-:18].[K+:19].[O-:59][C:60]([CH3:61])=[O:62].[O-:63][C:64]([CH3:65])=[O:66].[O:67]1[CH2:68][CH2:69][CH2:70][CH2:71]1.[Pd+2:58].[c:20]1([B-:21]([c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)([c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[cH:40][cH:41][cH:42][cH:43][cH:44]1.[c:8]1([CH3:17])[c:9]([B:14]([OH:15])[OH:16])[cH:10][cH:11][cH:12][cH:13]1>>[c:2]1(-[c:9]2[c:8]([CH3:17])[cH:13][cH:12][cH:11][cH:10]2)[cH:3][cH:4][cH:5][cH:6][n:7]1