HRID151540

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID813

Potassium cation

K+

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID16028

Tetrabutylammonium

C16H36N+

HCID30165

Iodide ion

I-

HCID158654

Phenol, 5-amino-2-chloro-4-fluoro-

C6H5ClFNO

HCID317685

cyclopentyl tosylate

C12H16O3S

PRODUCTS

产物

HCID15279389

4-Chloro-5-(cyclopentyloxy)-2-fluorobenzenamine

C11H13ClFNO

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-cb0e19c7bdd94bd6a3ebc68eae921d11
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-:31].[CH3:32][CH2:33][CH2:34][CH2:35][N+:36]([CH2:37][CH2:38][CH2:39][CH3:40])([CH2:41][CH2:42][CH2:43][CH3:44])[CH2:45][CH2:46][CH2:47][CH3:48].[CH3:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1.[I-:28].[K+:27].[NH2:1][c:2]1[c:3]([F:10])[cH:4][c:5]([Cl:9])[c:6]([OH:8])[cH:7]1.[Na+:30].[OH-:29].[OH2:56].[c:11]1([CH3:12])[cH:13][cH:14][c:15]([S:16]([O:17][CH:21]2[CH2:22][CH2:23][CH2:24][CH2:25]2)(=[O:18])=[O:19])[cH:20][cH:26]1>>[NH2:1][c:2]1[c:3]([F:10])[cH:4][c:5]([Cl:9])[c:6]([O:8][CH:21]2[CH2:22][CH2:23][CH2:24][CH2:25]2)[cH:7]1