HRID690435

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID16028

Tetrabutylammonium

C16H36N+

HCID61778

Bisulfate anion

HO4S-

HCID94544

1-(Bromomethyl)-3-phenoxybenzene

C13H11BrO

HCID10681171

未命名化合物

PRODUCTS

生成物

结构：CCOc1ccc(C(COCc2cccc(Oc3ccccc3)c2)C(F)(F)F)cc1

HCID10669581

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-16768e5209b6438f9a0be9fa114565d8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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