HRID2126691

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID1140

Toluene

C7H8

HCID17208

Benzyltriethylammonium

C13H22N+

HCID31215

Triethyl phosphite

C6H15O3P

HCID19975435

5-Fluoro-2-(4-fluorophenyl)-2,3-dihydro-1H-inden-1-one

C15H10F2O

PRODUCTS

生成物

HCID19975432

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-36d347d15ad24d15b8ae09880db914d0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[CH2:19]([O:21][P:20]([O:22][CH2:23][CH3:24])[O:25][CH2:26][CH3:27])[CH3:28].[CH2:32]([N+:33]([CH2:34][CH3:35])([CH2:36][CH3:37])[CH2:38][CH3:39])[c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[Cl-:31].[F:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[C:7](=[O:11])[CH:6]([c:12]1[cH:13][cH:14][c:15]([F:18])[cH:16][cH:17]1)[CH2:5]2.[Na+:30].[OH-:29]>>[F:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[C:7](=[O:11])[C:6]([c:12]1[cH:13][cH:14][c:15]([F:18])[cH:16][cH:17]1)([OH:21])[CH2:5]2