HRID165082

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8006

1-Bromo-3-chloropropane

C3H6BrCl

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

Hexane

C6H14

HCID8857

Ethyl Acetate

C4H8O2

HCID67473

1,7-Phenanthroline

C12H8N2

HCID10516471

未命名化合物

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

产物

HCID10831736

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-93d783cbb1d348ddab229ecd192ac0f0
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:45][CH2:46][CH2:47][CH2:48][Cl:49].[CH2:40]([Li:41])[CH2:42][CH2:43][CH3:44].[CH3:1][O:2][c:3]1[c:4]([O:18][CH3:19])[cH:5][c:6]([CH2:9][S:10][c:11]2[cH:12][cH:13][c:14]([CH3:17])[cH:15][cH:16]2)[cH:7][cH:8]1.[CH3:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39].[CH3:55][CH2:56][O:57][C:58](=[O:59])[CH3:60].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1.[n:20]1[c:21]2[c:22]([cH:23][cH:24][c:25]3[c:26]2[cH:27][cH:28][cH:29][n:30]3)[cH:31][cH:32][cH:33]1>>[CH3:1][O:2][c:3]1[c:4]([O:18][CH3:19])[cH:5][c:6]([CH:9]([S:10][c:11]2[cH:12][cH:13][c:14]([CH3:17])[cH:15][cH:16]2)[CH2:46][CH2:47][CH2:48][Cl:49])[cH:7][cH:8]1