HRID105263

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID3283

Diethyl Ether

C4H10O

HCID3776

Isopropanol

C3H8O

HCID8028

Tetrahydrofuran

C4H8O

HCID97268

Di-tert-butyl azodicarboxylate

C10H18N2O4

HCID520948

3-Fluoro-4-nitrophenol

C6H4FNO3

HCID621893

Diphenyl-2-pyridylphosphine

C17H14NP

PRODUCTS

生成物

HCID13538652

2-Fluoro-1-nitro-4-[(propan-2-yl)oxy]benzene

C9H10FNO3

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bbb68f24647b42aaad41a074ea4cd246
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

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