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Merck
CN

102369

Sigma-Aldrich

对二硝基苯

98%

别名:

p-dinitrobenzene, para-Dinitrobenzene

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About This Item

线性分子式:
C6H4(NO2)2
CAS号:
分子量:
168.11
Beilstein:
1105828
EC 号:
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22

质量水平

方案

98%

沸点

183.4 °C/34 mmHg (lit.)

mp

170-173 °C (lit.)

溶解性

alcohol: soluble 1g in 300ml
boiling water: soluble 1g in 555ml
cold water: soluble 1g in 12,500ml
benzene: very slightly soluble
chloroform: very slightly soluble
ethyl acetate: very slightly soluble

密度

1.625 g/mL at 25 °C (lit.)

官能团

nitro

SMILES字符串

[O-][N+](=O)c1ccc(cc1)[N+]([O-])=O

InChI

1S/C6H4N2O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4H

InChI key

FYFDQJRXFWGIBS-UHFFFAOYSA-N

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一般描述

二硝基苯通常用于含有硝酸铵的工业炸药中。 1,4-二硝基苯可通过电子捕获或电荷交换形成负分子离子M-·

应用

在一项研究中,1,4-二硝基苯被用于通过新型大气压光电离质谱法,在负离子模式下对一些化合物进行分析过程中的电离机理和溶剂效应进行评估。 1,4-二硝基苯可用于合成染料和染料中间体。

制备说明

1克1,4-二硝基苯溶于12500 ml冷水、555 ml沸水和300 ml乙醇中。

警示用语:

Danger

危险分类

Acute Tox. 1 Dermal - Acute Tox. 1 Inhalation - Acute Tox. 2 Oral - Aquatic Acute 1 - Aquatic Chronic 1 - STOT RE 2

储存分类代码

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

WGK

WGK 3

闪点(°F)

302.0 °F - closed cup

闪点(°C)

150 °C - closed cup

个人防护装备

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges

法规信息

危险化学品

历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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Tiina J Kauppila et al.
Journal of the American Society for Mass Spectrometry, 15(2), 203-211 (2004-02-10)
The ionization mechanism in the novel atmospheric pressure photoionization mass spectrometry (APPI-MS) in negative ion mode was studied thoroughly by the analysis of seven compounds in 17 solvent systems. The compounds possessed either gas-phase acidity or positive electron affinity, whereas
Polymer sensors for nitroaromatic explosives detection.
Toal SJ and Trogler WC.
Journal of Materials Chemistry, 16(28), 2871-2883 (2006)
Silvia M Barolo et al.
The Journal of organic chemistry, 71(22), 8493-8499 (2006-10-27)
The photostimulated intramolecular ortho-arylation reactions of bromoarenes linked with pendant phenoxy containing N-substituted tetrahydroisoquinolines in liquid ammonia afforded aporphine (54-82% yield) alkaloid derivatives via SRN1 reactions. This strategy was extended for the first time to the synthesis of a homoaporphine
N Kessler et al.
Proteins, 34(3), 383-394 (1999-02-19)
The sequences of the variable regions of three monoclonal antibodies with different specificities to cholesterol monohydrate and 1,4-dinitrobenzene crystals were determined. The structures of their binding sites were then modeled, based on homology to other antibodies of known structure. Two
Akio Kamimura et al.
Molecules (Basel, Switzerland), 17(5), 4782-4790 (2012-04-27)
S(RN)1-type coupling adducts are readily prepared by the reaction between a-sulfonylesters or a-cyanosulfones and gem-dinitro compounds in ionic liquids. The reactions progress smoothly and recovered ionic liquids can be used for several iterations, as long as they are washed with

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