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名称

4-硝基吡啶-N-氧化物

分子类型

小分子

别名

4-硝基氮氧化吡啶

英文别名

英文名称

4-Nitropyridine N-oxide

货号

N119979-100g

包装规格

100g

浓度

≥98%

储存温度

充氩

运输条件

常规运输

敏感性

对湿度敏感

产品介绍

4-Nitropyridine N-oxide has been reported as a quorum-sensing inhibitor, having IC50 value of 24μg/ml. Facile one-pot arylation and alkylation of 4-nitropyridine N-oxide has been reported. 4-Nitropyridine N-oxide can be prepared from pyridine by oxidation with peracetic acid and nitration. Primary photochemical process of 4-nitropyridine N-oxide has been investigated by steady-light irradiation and a flash spectroscopic method. 4-Nitropyridine N-oxide may be used in the preparation of several 4-substituted pyridine-N-oxides and pyridines. 4-Nitropyridine N-oxide has been reported as a quorum-sensing inhibitor, having IC50 value of 24μg/ml. Facile one-pot arylation and alkylation of 4-nitropyridine N-oxide has been reported. 4-Nitropyridine N-oxide can be prepared from pyridine by oxidation with peracetic acid and nitration. Primary photochemical process of 4-nitropyridine N-oxide has been investigated by steady-light irradiation and a flash spectroscopic method. 4-Nitropyridine N-oxide may be used in the preparation of several 4-substituted pyridine-N-oxides and pyridines.

CAS号

1124-33-0

分子式

C5H4N2O3

分子量

140.1 g/mol

EC号

214-395-4

MDL号

MFCD00006206

PubChem编号

14300

Isomeric SMILES

C1=C[N+](=CC=C1[N+](=O)[O-])[O-]

IIUPAC Name

4-nitro-1-oxidopyridin-1-ium

INCHI

1S/C5H4N2O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4H

InChi Key

RXKNNAKAVAHBNK-UHFFFAOYSA-N

Smiles

C1=C[N+](=CC=C1[N+](=O)[O-])[O-]

PubChem SID

488181970

熔点

161°C

氢键供体数Hydrogen Bond Donor Count

氢键受体数Hydrogen Bond Acceptor Count

可旋转键计数Rotatable Bond Count

精确质量Exact Mass

140.022 Da

单同位素质量Monoisotopic Mass

140.022 Da

拓扑极表面积Topological Polar Surface Area

71.300 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

125.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

-0.600

Class

6.1

Reaxy-Rn

124331

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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