HRID193618

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID813

Potassium cation

K+

HCID8857

Ethyl acetate

C4H8O2

HCID28557

18-Crown-6

C12H24O6

HCID2773684

6-chloro-2-fluoro-3-methylphenol

C7H6ClFO

HCID4574913

未命名化合物

HCID15165443

4-Bromo-3-fluorobenzonitrile

C7H3BrFN

PRODUCTS

生成物

HCID68720989

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7c90d6d09ad7484196b0ab250fcfd2fb
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:35][c:36]1[c:37]([F:44])[cH:38][c:39]([C:40]#[N:41])[cH:42][cH:43]1.[CH3:29][C:30]([CH3:31])([O-:32])[CH3:33].[CH3:45][S:46]([CH3:47])=[O:48].[CH3:49][CH2:50][O:51][C:52]([CH3:53])=[O:54].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH3:10])[c:6]([F:9])[c:7]1[OH:8].[K+:34].[O:11]1[CH2:12][CH2:13][O:14][CH2:15][CH2:16][O:17][CH2:18][CH2:19][O:20][CH2:21][CH2:22][O:23][CH2:24][CH2:25][O:26][CH2:27][CH2:28]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH3:10])[c:6]([F:9])[c:7]1[O:8][c:36]1[c:37]([F:44])[cH:38][c:39]([C:40]#[N:41])[cH:42][cH:43]1