HRID205388

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID887

Methanol

CH4O

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID15413

Methyl tert-butyl ether

C5H12O

HCID19660

Carbonate

CO3-2

结构：C[Si](C)(C)C#Cc1cnc2c(C(F)(F)F)cc(-c3ccc(C(F)(F)F)cc3)cn12

HCID86608010

8-Trifluoromethyl-6-(4-trifluoromethyl-phenyl)-3-trimethylsilanylethynyl-imidazo[1,2-a]pyridine

C20H16F6N2Si

PRODUCTS

生成物

结构：C#Cc1cnc2c(C(F)(F)F)cc(-c3ccc(C(F)(F)F)cc3)cn12

HCID86608011

3-Ethynyl-8-trifluoromethyl-6-(4-trifluoromethyl-phenyl)-imidazo[1,2-a]pyridine

C17H8F6N2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-267d35961a0342ac934b50338498b59d
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

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