HRID172176

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID813

Potassium cation

K+

HCID961

Hydroxide

HO-

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID28179

Fluoride

F-

HCID76112

(o-Chlorophenyl)acetonitrile

C8H6ClN

HCID105144

Palladium(2+)

Pd+2

HCID2734215

2-(Di-tert-butylphosphino)biphenyl

C20H27P

HCID178419126

未命名化合物

PRODUCTS

生成物

HCID334101

2-Biphenylacetonitrile

C14H11N

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a6b5c682f25c4f1c9c5929309c70f4dd
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:1]([P:2]([C:3]([CH3:4])([CH3:5])[CH3:18])[c:6]1[c:7](-[c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:8][cH:9][cH:10][cH:11]1)([CH3:19])([CH3:20])[CH3:21].[C:43]([O-:44])(=[O:45])[CH3:46].[C:48]([O-:49])(=[O:50])[CH3:51].[CH2:52]1[O:53][CH2:54][CH2:55][CH2:56]1.[Cl:33][c:34]1[cH:35][cH:39][cH:40][cH:41][c:42]1[CH2:36][C:37]#[N:38].[F-:31].[K+:32].[OH-:22].[OH-:23].[Pd+2:47].[c:24]1([B+2:25])[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[c:6]1([CH2:36][C:37]#[N:38])[c:7](-[c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:8][cH:9][cH:10][cH:11]1