HRID668359

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID259

Bromide

Br-

HCID260

Hydrogen Bromide

BrH

HCID2681

Alkyl trimethyl ammonium compound C16 (ATMAC C16)

C19H42N+

结构：COc1cccc2c1nc(-c1c(F)cccc1F)n2Cc1c(F)cccc1F

HCID492672

未命名化合物

PRODUCTS

生成物

结构：Oc1cccc2c1nc(-c1c(F)cccc1F)n2Cc1c(F)cccc1F

HCID22482479

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3bcb2ce0c3594bb588c2867835b71812
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

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