HRID1115358

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID923

Sodium ion

Na+

HCID6342

Acetonitrile

C2H3N

HCID6344

Dichloromethane

CH2Cl2

HCID19660

Carbonate

CO3-2

HCID30165

Iodide ion

I-

HCID22386508

tert-Butyl 3-(hydroxymethyl)piperazine-1-carboxylate

C10H20N2O3

HCID23527396

2-[4-(Bromomethyl)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol

C10H7BrF6O

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCN(Cc2ccc(C(O)(C(F)(F)F)C(F)(F)F)cc2)C(CO)C1

HCID87253414

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-35a25667cf5e47d3b9ee282e1637aff0
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:16][CH2:17][c:18]1[cH:19][cH:20][c:21]([C:24]([C:25]([F:26])([F:27])[F:28])([C:29]([F:30])([F:31])[F:32])[OH:33])[cH:22][cH:23]1.[C:36](=[O:37])([O-:38])[O-:39].[CH3:42][C:43]#[N:44].[Cl:45][CH2:46][Cl:47].[I-:35].[K+:40].[K+:41].[Na+:34].[OH:1][CH2:2][CH:3]1[CH2:4][N:5]([C:9](=[O:10])[O:11][C:12]([CH3:13])([CH3:14])[CH3:15])[CH2:6][CH2:7][NH:8]1>>[OH:1][CH2:2][CH:3]1[CH2:4][N:5]([C:9](=[O:10])[O:11][C:12]([CH3:13])([CH3:14])[CH3:15])[CH2:6][CH2:7][N:8]1[CH2:17][c:18]1[cH:19][cH:20][c:21]([C:24]([C:25]([F:26])([F:27])[F:28])([C:29]([F:30])([F:31])[F:32])[OH:33])[cH:22][cH:23]1