544221
2-氟-5-硝基苯腈
97%
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关于此项目
线性分子式:
FC6H3(CN)NO2
化学文摘社编号:
分子量:
166.11
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22
方案
97%
mp
76-80 °C (lit.)
官能团
fluoro
nitrile
nitro
SMILES字符串
[O-][N+](=O)c1ccc(F)c(c1)C#N
InChI
1S/C7H3FN2O2/c8-7-2-1-6(10(11)12)3-5(7)4-9/h1-3H
InChI key
YLACBMHBZVYOAP-UHFFFAOYSA-N
一般描述
2-Fluoro-5-nitrobenzonitrile can be prepared from 2-fluorobenzonitrile via nitration.
应用
2-Fluoro-5-nitrobenzonitrile may be used in the preparation of:
- 2-fluoro-5-aminobenzonitrile
- ethyl 3-amino-5-nitro-benzo[b]thiophene-2-carboxylate
- 1-methyl-5-nitro-1H-indazol-3-ylamine
警示用语：
Warning
危险分类
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
靶器官
Respiratory system
储存分类代码
11 - Combustible Solids
WGK
WGK 3
闪点(°F)
Not applicable
闪点(°C)
Not applicable
个人防护装备
dust mask type N95 (US), Eyeshields, Gloves
法规信息
新产品
此项目有
Synthesis, antiproliferative activity, and in silico insights of new 3-benzoylamino-benzo [b] thiophene derivatives.
Martorana A, et al.
European Journal of Medicinal Chemistry, 90, 537-546 (2015)
Mimi L Quan et al.
Journal of medicinal chemistry, 48(6), 1729-1744 (2005-03-18)
Modification of a series of pyrazole factor Xa inhibitors to incorporate an aminobenzisoxazole as the P(1) ligand resulted in compounds with improved selectivity for factor Xa relative to trypsin and plasma kallikrein. Further optimization of the P(4) moiety led to
A method for the regioselective synthesis of 1-alkyl-1H-indazoles.
Liu HJ, et al.
Tetrahedron, 69(19), 3907-3912 (2013)
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