HRID191870

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID813

Potassium cation

K+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID7914

Isopropyl ether

C6H14O

HCID16028

Tetrabutylammonium

C16H36N+

HCID2724271

2-Chloromethyl 2-(trimethylsilyl)ethyl ether

C6H15ClOSi

HCID178526495

未命名化合物

PRODUCTS

生成物

结构：C[Si](C)(C)CCOCn1nc(I)c2cc([N+](=O)[O-])ccc21

HCID22567272

3-Iodo-5-nitro-1-{[2-(trimethylsilyl)ethoxy]methyl}-1H-indazole

C13H18IN3O3Si

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-58b58d41b6cc49dea1203afa3cd566a9
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

[Br-:25].[CH3:16][Si:17]([CH2:18][CH2:19][O:20][CH2:21][Cl:22])([CH3:23])[CH3:24].[CH3:26][CH2:27][CH2:28][CH2:29][N+:30]([CH2:31][CH2:32][CH2:33][CH3:34])([CH2:35][CH2:36][CH2:37][CH3:38])[CH2:39][CH2:40][CH2:41][CH3:42].[CH:43]([O:44][CH:45]([CH3:46])[CH3:47])([CH3:48])[CH3:49].[Cl:51][CH2:52][Cl:53].[I:3][c:4]1[n:5][nH:6][c:7]2[cH:8][cH:9][c:10]([N+:13](=[O:14])[O-:15])[cH:11][c:12]12.[K+:2].[OH-:1].[OH2:50]>>[I:3][c:4]1[n:5][n:6]([CH2:21][O:20][CH2:19][CH2:18][Si:17]([CH3:16])([CH3:23])[CH3:24])[c:7]2[cH:8][cH:9][c:10]([N+:13](=[O:14])[O-:15])[cH:11][c:12]12