HRID182731

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

2 次

HCID961

Hydroxide

HO-

HCID19660

Carbonate

CO3-2

HCID28179

Fluoride

F-

结构：CCOc1c(OCc2ccc(S(C)(=O)=O)cc2Cl)cccc1C(=O)c1cn([Si](C(C)C)(C(C)C)C(C)C)c2ncccc12

HCID58087362

未命名化合物

PRODUCTS

生成物

结构：CCOc1c(OCc2ccc(S(C)(=O)=O)cc2Cl)cccc1C(=O)c1c[nH]c2ncccc12

HCID58086239

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5aa3245babba4d709d7fdbb00ba0f546
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

[CH3:54][OH:55].[Cl:1][c:2]1[c:3]([CH2:4][O:5][c:6]2[c:7]([O:33][CH2:34][CH3:35])[c:8]([C:12](=[O:13])[c:14]3[cH:15][n:16]([Si:23]([CH:24]([CH3:25])[CH3:26])([CH:27]([CH3:28])[CH3:29])[CH:30]([CH3:31])[CH3:32])[c:17]4[n:18][cH:19][cH:20][cH:21][c:22]34)[cH:9][cH:10][cH:11]2)[cH:36][cH:37][c:38]([S:40](=[O:41])(=[O:42])[CH3:43])[cH:39]1.[F-:46].[K+:45].[K+:47].[Na+:48].[Na+:49].[O-:50][C:51](=[O:52])[O-:53].[OH-:44]>>[Cl:1][c:2]1[c:3]([CH2:4][O:5][c:6]2[c:7]([O:33][CH2:34][CH3:35])[c:8]([C:12](=[O:13])[c:14]3[cH:15][nH:16][c:17]4[n:18][cH:19][cH:20][cH:21][c:22]34)[cH:9][cH:10][cH:11]2)[cH:36][cH:37][c:38]([S:40](=[O:41])(=[O:42])[CH3:43])[cH:39]1