HRID1151894

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID813

Potassium cation

K+

HCID961

Hydroxide

HO-

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID16028

Tetrabutylammonium

C16H36N+

HCID13318871

4-(Diethylboranyl)pyridine

C9H14BN

HCID40425364

4-Bromo-2-fluoro-N,N-dimethylaniline

C8H9BrFN

PRODUCTS

生成物

HCID67202185

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-21f0cc370ac84d2794ab57cd095dfa50
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[Br-:31].[Br:1][c:2]1[cH:3][c:4]([F:11])[c:5]([N:6]([CH3:7])[CH3:8])[cH:9][cH:10]1.[CH2:12]([B:13]([CH2:14][CH3:21])[c:15]1[cH:16][cH:17][n:18][cH:19][cH:20]1)[CH3:22].[CH3:25][CH2:26][O:27][C:28](=[O:29])[CH3:30].[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].[K+:24].[O:49]1[CH2:50][CH2:51][CH2:52][CH2:53]1.[OH-:23]>>[c:2]1(-[c:15]2[cH:16][cH:17][n:18][cH:19][cH:20]2)[cH:3][c:4]([F:11])[c:5]([N:6]([CH3:7])[CH3:8])[cH:9][cH:10]1