HRID145365

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6378

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

C3H6O

HCID8471

Triethylamine

C6H15N

HCID12679

Hexamethylphosphoramide

C6H18N3OP

HCID563758

(8-Bromooctyl)benzene

C14H21Br

HCID135778511

未命名化合物

PRODUCTS

生成物

结构：COc1cc([N+](=O)[O-])c2nccc(C)c2c1OCCCCCCCCc1ccccc1

HCID54345436

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1a772264fa7646b4875ac0f89351843b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[Br:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[CH2:44]1[O:45][CH:46]1[CH3:47].[CH3:33][N:34]([CH3:35])[P:36]([N:37]([CH3:38])[CH3:39])([N:40]([CH3:41])[CH3:42])=[O:43].[CH3:48][CH2:49][N:50]([CH2:51][CH3:52])[CH2:53][CH3:54].[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][CH2:25][CH2:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1