HRID106943

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID957

1-Octanol

C8H18O

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID220568

Diethyl azodicarboxylate

C6H10N2O4

HCID19046961

未命名化合物

PRODUCTS

生成物

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

HCID19046959

2-Fluoro-3-(octyloxy)-6-[4-(octyloxy)phenyl]pyridine

C27H40FNO2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e55b543f164d4313aba2b118d2e231f4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH2:55]([CH2:56][CH2:57][CH2:58][CH2:59][CH2:60][CH2:61][CH3:62])[OH:63].[F:32][c:33]1[n:34][c:35](-[c:40]2[cH:41][cH:42][c:43]([O:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][CH2:53][CH3:54])[cH:44][cH:45]2)[cH:36][cH:37][c:38]1[OH:39].[O:1]=[C:2]([O:3][CH2:4][CH3:5])[N:6]=[N:7][C:8]([O:9][CH2:10][CH3:11])=[O:12].[O:64]1[CH2:65][CH2:66][CH2:67][CH2:68]1.[c:13]1([P:14]([c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[F:32][c:33]1[n:34][c:35](-[c:40]2[cH:41][cH:42][c:43]([O:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][CH2:53][CH3:54])[cH:44][cH:45]2)[cH:36][cH:37][c:38]1[O:39][CH2:55][CH2:56][CH2:57][CH2:58][CH2:59][CH2:60][CH2:61][CH3:62]