HRID1535664

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID19660

Carbonate

CO3-2

结构：CC(=O)OCC1OC(Br)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

HCID102932

未命名化合物

HCID124611

Benzyltributylammonium bromide

C19H34N+

HCID13352352

1-(3-Hydroxythiophen-2-yl)ethan-1-one

C6H6O2S

PRODUCTS

生成物

结构：CC(=O)OCC1OC(Oc2ccsc2C(C)=O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

HCID21961228

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d4a50bc417d545b682592337267aa6dc
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:10]([CH3:11])(=[O:12])[O:13][CH:14]1[CH:15]([Br:33])[O:16][CH:17]([CH2:28][O:29][C:30]([CH3:31])=[O:32])[CH:18]([O:24][C:25]([CH3:26])=[O:27])[CH:19]1[O:20][C:21]([CH3:22])=[O:23].[C:34](=[O:35])([O-:36])[O-:37].[CH2:45]([N+: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])[c:59]1[cH:60][cH:61][cH:62][cH:63][cH:64]1.[Cl-:44].[Cl:41][CH2:42][Cl:43].[K+:38].[K+:39].[OH2:40].[OH:1][c:2]1[c:3]([C:7]([CH3:8])=[O:9])[s:4][cH:5][cH:6]1>>[O:1]([c:2]1[c:3]([C:7]([CH3:8])=[O:9])[s:4][cH:5][cH:6]1)[CH:15]1[CH:14]([O:13][C:10]([CH3:11])=[O:12])[CH:19]([O:20][C:21]([CH3:22])=[O:23])[CH:18]([O:24][C:25]([CH3:26])=[O:27])[CH:17]([CH2:28][O:29][C:30]([CH3:31])=[O:32])[O:16]1