HRID1563788

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID8857

Ethyl acetate

C4H8O2

HCID4622928

Cyanomethylenetributylphosphorane

C14H28NP

HCID9901028

2-[(4-Chlorobenzene-1-sulfonyl)methyl]-1,4-difluorobenzene

C13H9ClF2O2S

结构：CC(C)(C)[Si](OCCSCCO)(c1ccccc1)c1ccccc1

HCID59750807

2-[[2-[[(1,1-Dimethylethyl)diphenylsilyl]oxy]ethyl]thio]ethanol

C20H28O2SSi

PRODUCTS

生成物

结构：CC(C)(C)[Si](OCCSCCC(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1)(c1ccccc1)c1ccccc1

HCID59028247

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b9a75aa88d95485eaafeae897545257b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:20]([CH3:21])([CH3:22])([CH3:23])[Si:24]([O:25][CH2:26][CH2:27][S:28][CH2:29][CH2:30][OH:31])([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)[c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[C:44]([CH:45]=[P:46]([CH2:47][CH2:48][CH2:49][CH3:50])([CH2:51][CH2:52][CH2:53][CH3:54])[CH2:55][CH2:56][CH2:57][CH3:58])#[N:59].[CH3:60][CH2:61][O:62][C:63](=[O:64])[CH3:65].[CH3:66][c:67]1[cH:68][cH:69][cH:70][cH:71][cH:72]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[CH2:11][c:12]2[c:13]([F:19])[cH:14][cH:15][c:16]([F:18])[cH:17]2)[cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[CH:11]([c:12]2[c:13]([F:19])[cH:14][cH:15][c:16]([F:18])[cH:17]2)[CH2:30][CH2:29][S:28][CH2:27][CH2:26][O:25][Si:24]([C:20]([CH3:21])([CH3:22])[CH3:23])([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[cH:6][cH:7]1