HRID675580

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6212

Chloroform

CHCl3

HCID6378

(+/-)-1,2-Propylene oxide

C3H6O

HCID8471

Triethylamine

C6H15N

HCID12679

Hexamethylphosphoramide

C6H18N3OP

HCID561788

(6-Bromohexyl)benzene

C12H17Br

HCID135778511

未命名化合物

PRODUCTS

生成物

结构：COc1cc([N+](=O)[O-])c2nccc(C)c2c1OCCCCCCc1ccccc1

HCID54563832

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b1f2f20d90684878803dd585b4235511
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:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1.[CH2:42]1[O:43][CH:44]1[CH3:45].[CH3:31][N:32]([CH3:33])[P:34]([N:35]([CH3:36])[CH3:37])([N:38]([CH3:39])[CH3:40])=[O:41].[CH3:50][CH2:51][N:52]([CH2:53][CH3:54])[CH2:55][CH3:56].[Cl:46][CH:47]([Cl:48])[Cl:49].[OH:1][c:2]1[c:3]2[c:4]([CH3:17])[cH:5][cH:6][n:7][c:8]2[c:9]([N+:14](=[O:15])[O-:16])[cH:10][c:11]1[O:12][CH3:13]>>[O:1]([c:2]1[c:3]2[c:4]([CH3:17])[cH:5][cH:6][n:7][c:8]2[c:9]([N+:14](=[O:15])[O-:16])[cH:10][c:11]1[O:12][CH3:13])[CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1