HRID121783

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID961

Hydroxide

HO-

HCID962

Water

H2O

2 次

HCID15413

Methyl tert-butyl ether

C5H12O

HCID28486

Lithium ion

Li+

HCID3368300

未命名化合物

HCID11118722

Dimethyl (3,3-difluoro-2-oxoheptyl)phosphonate

C9H17F2O4P

PRODUCTS

生成物

结构：CCCCC(F)(F)C(=O)C=CC1C(OC(=O)c2ccccc2)CC2OC(=O)CC21

HCID73694836

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2ef5d4265f8f4b3f83791d1c6e9d74e7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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