HRID2328516

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID7912

Diisopropylamine

C6H15N

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID8140

1-Bromooctane

C8H17Br

HCID17911500

未命名化合物

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

生成物

结构：CCCCCCCCOc1ccc(-c2ccc(CCCCCCCC)c(F)n2)cc1

HCID19046932

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-26a0c1dbe9d6437ebdf425eac7b70b8f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[Br:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH3:43].[CH2:8]([Li:9])[CH2:10][CH2:11][CH3:12].[CH3:49][CH2:50][CH2:51][CH2:52][CH2:53][CH3:54].[CH:1]([NH:2][CH:3]([CH3:4])[CH3:5])([CH3:6])[CH3:7].[F:13][c:14]1[n:15][c:16](-[c:20]2[cH:21][cH:22][c:23]([O:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH3:34])[cH:24][cH:25]2)[cH:17][cH:18][cH:19]1.[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1.[OH2:55]>>[F:13][c:14]1[n:15][c:16](-[c:20]2[cH:21][cH:22][c:23]([O:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH3:34])[cH:24][cH:25]2)[cH:17][cH:18][c:19]1[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH3:43]