HRID166824

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

3 次

HCID1061

Phosphate

O4P-3

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

HCID31275

1,4-Dioxane

C4H8O2

HCID66053

N,N-Dimethylethylenediamine

C4H12N2

HCID262234

4-Bromo-2-methoxyphenol

C7H7BrO2

HCID22049900

未命名化合物

PRODUCTS

生成物

结构：COc1cc(-n2ccc(OCc3ccc(F)cc3)cc2=O)ccc1O

HCID68230725

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ca12754ddcb44b608a6cc0281ede08e6
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

[Br:17][c:18]1[cH:19][c:20]([O:25][CH3:26])[c:21]([OH:24])[cH:22][cH:23]1.[CH3:27][N:28]([CH3:29])[CH2:30][CH2:31][NH2:32].[Cl:41][CH2:42][Cl:43].[Cu:44][I:45].[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][O:7][c:8]2[cH:9][c:10](=[O:14])[nH:11][cH:12][cH:13]2)[cH:15][cH:16]1.[K+:38].[K+:39].[K+:40].[O:46]1[CH2:47][CH2:48][O:49][CH2:50][CH2:51]1.[O:52]=[CH:53][N:54]([CH3:55])[CH3:56].[P:33]([O-:34])([O-:35])([O-:36])=[O:37]>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][O:7][c:8]2[cH:9][c:10](=[O:14])[n:11](-[c:18]3[cH:19][c:20]([O:25][CH3:26])[c:21]([OH:24])[cH:22][cH:23]3)[cH:12][cH:13]2)[cH:15][cH:16]1