HRID1130991

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID7835

Epichlorohydrin

C3H5ClO

HCID8071

未命名化合物

HCID16028

Tetrabutylammonium

C16H36N+

HCID61778

Bisulfate anion

HO4S-

HCID86266

2-Hydroxy-1-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-one

C12H16O4

PRODUCTS

生成物

HCID54395130

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e781ff8d25dc4af184de6b688e8d5f02
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH2:30]([N+:31]([CH2:32][CH2:33][CH2:34][CH3:35])([CH2:36][CH2:37][CH2:38][CH3:39])[CH2:40][CH2:41][CH2:42][CH3:43])[CH2:44][CH2:45][CH3:46].[CH3:47][O:48][CH2:49][CH2:50][O:51][CH3:52].[Cl:1][CH2:2][CH:3]1[CH2:4][O:5]1.[Na+:7].[OH-:6].[OH2:8].[OH:9][C:10]([C:11](=[O:12])[c:13]1[cH:14][cH:15][c:16]([O:19][CH2:20][CH2:21][OH:22])[cH:17][cH:18]1)([CH3:23])[CH3:24].[S:25]([O-:26])([OH:27])(=[O:28])=[O:29]>>[CH2:2]([CH:3]1[CH2:4][O:5]1)[O:22][CH2:21][CH2:20][O:19][c:16]1[cH:15][cH:14][c:13]([C:11]([C:10]([OH:9])([CH3:23])[CH3:24])=[O:12])[cH:18][cH:17]1