HRID1119504

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID3283

Diethyl Ether

C4H10O

HCID8400

Benzoin

C14H12O2

结构：CCOC(CCP(=O)(OCC)OCC)(C(=O)c1ccccc1)c1ccccc1

HCID53968270

未命名化合物

PRODUCTS

生成物

结构：CCOC(CCP(=O)(O)OCC)(C(=O)c1ccccc1)c1ccccc1

HCID53905058

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d5a492e279364eb6925913da9eed9990
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

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