HRID1535652

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID1117

Sulfate

O4S-2

HCID6344

Dichloromethane

CH2Cl2

HCID7858

Allyl alcohol

C3H6O

HCID7977

2-Chloropyridine

C5H4ClN

HCID67749

Trifluoromethanesulfonic anhydride

C2F6O5S2

HCID70194

2,2-Dinitropropanol

C3H6N2O5

HCID10932223

2-Propen-1-yl 1,1,1-trifluoromethanesulfonate

C4H5F3O3S

PRODUCTS

生成物

HCID71623087

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4a9df2b602a4421e900a9414e1cb55c7
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

[CH2:55]([Cl:56])[Cl:57].[Cl:5][c:6]1[n:7][cH:8][cH:9][cH:10][cH:11]1.[F:12][C:13]([S:14]([O:15][S:16]([C:17]([F:18])([F:19])[F:20])(=[O:21])=[O:22])(=[O:23])=[O:24])([F:25])[F:26].[N+:27](=[O:28])([O-:29])[C:30]([CH2:31][OH:32])([CH3:33])[N+:34](=[O:35])[O-:36].[Na+:48].[Na+:49].[O-:50][S:51](=[O:52])(=[O:53])[O-:54].[OH:1][CH2:2][CH:3]=[CH2:4].[S:37]([O:38][CH2:39][CH:40]=[CH2:41])([C:42]([F:43])([F:44])[F:45])(=[O:46])=[O:47]>>[CH2:2]=[CH:3][CH2:4][O:32][CH2:31][C:30]([N+:27](=[O:28])[O-:29])([CH3:33])[N+:34](=[O:35])[O-:36]