HRID201773

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7505

Benzonitrile

C7H5N

HCID9870

Fluorosulfuric acid, methyl ester

CH3FO3S

结构：FC(=C(C(F)(F)F)C(F)(F)F)C(F)(F)C(F)(F)F

HCID74105

Perfluoro(2-methylpent-2-ene)

C6F12

HCID2758495

未命名化合物

HCID4398340

未命名化合物

2 次

结构：FC(F)(F)[C-](C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)F

HCID12751196

未命名化合物

PRODUCTS

生成物

结构：CC(C(F)(F)F)(C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)F

HCID11515508

2-Methyl-2-trifluoromethylperfluoropentane

C7H3F13

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0688751af22144fe8c2a47f9fe188aa4
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

[CH3:26][N:27]([S+:28]([N:29]([CH3:30])[CH3:31])[N:32]([CH3:33])[CH3:34])[CH3:35].[CH3:36][N:37]([CH3:38])[S+:39]([N:40]([CH3:41])[CH3:42])[N:43]([CH3:44])[CH3:45].[CH3:46][Si-:47]([CH3:48])([F:49])([F:50])[CH3:51].[F:52][C:53]([F:54])([F:55])[C:56]([C:57]([F:58])([F:59])[F:60])=[C:61]([F:62])[C:63]([F:64])([F:65])[C:66]([F:67])([F:68])[F:69].[F:7][C:8]([C-:9]([C:10]([C:11]([C:12]([F:13])([F:14])[F:15])([F:16])[F:17])([F:18])[F:19])[C:20]([F:21])([F:22])[F:23])([F:24])[F:25].[N:70]#[C:71][c:72]1[cH:73][cH:74][cH:75][cH:76][cH:77]1.[S:1]([F:2])([O:3][CH3:4])(=[O:5])=[O:6]>>[F:7][C:8]([C:9]([C:10]([C:11]([C:12]([F:13])([F:14])[F:15])([F:16])[F:17])([F:18])[F:19])([C:20]([F:21])([F:22])[F:23])[CH3:26])([F:24])[F:25]