HRID204081

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID24290

未命名化合物

HCID30165

Iodide ion

I-

HCID2775133

1-Ethynyl-4-propylbenzene

C11H12

HCID19023068

2,6-Difluoro-4-iodobenzonitrile

C7H2F2IN

PRODUCTS

生成物

HCID67820093

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8ac58657d06e4e0e8907a040649731db
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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