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Merck
CN

74080

Sigma-Aldrich

4-硝基甲苯

purum, ≥98.0% (GC)

别名:

1-甲基-4-硝基苯

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线性分子式:
CH3C6H4NO2
化学文摘社编号:
分子量:
137.14
Beilstein:
1906911
EC 号:
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
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蒸汽密度

4.7 (vs air)

蒸汽压

5 mmHg ( 85 °C)

等级

purum

方案

≥98.0% (GC)

自燃温度

734 °F

沸点

238 °C (lit.)

mp

51-53 °C
52-54 °C (lit.)

密度

1.392 g/mL at 25 °C (lit.)

SMILES字符串

Cc1ccc(cc1)[N+]([O-])=O

InChI

1S/C7H7NO2/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3

InChI key

ZPTVNYMJQHSSEA-UHFFFAOYSA-N

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Danger

危险分类

Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Aquatic Chronic 2 - 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)

222.8 °F - closed cup

闪点(°C)

106.00 °C - closed cup

个人防护装备

Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges

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John Tomkinson
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 77(2), 539-540 (2010-07-06)
The title paper reports the ab initio calculated structure and vibrational spectra of 4-nitrotoluene. The calculated structure is wrong and the assignments are inconsistent with earlier work. We have recalculated the ab initio structure and reassigned the spectra in agreement
Patricia Guerra et al.
Journal of separation science, 31(15), 2891-2898 (2008-07-31)
Ion mobility spectrometry (IMS) is routinely used in screening checkpoints for the detection of explosives and illicit drugs but it mainly relies on the capture of particles on a swab surface for the detection. Solid phase microextraction (SPME) has been
S Ramalingam et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 75(4), 1308-1314 (2010-02-06)
In this work, the experimental and theoretical study on molecular structure and vibrational spectra of 4-nitrotoluene are studied. The FTIR and FTRaman experimental spectra of the molecule have been recorded in the range of 4000-100 cm(-1). Making use of the
Baoliang Chen et al.
Bioresource technology, 102(2), 716-723 (2010-09-25)
Biochar derived from agricultural biomass waste is increasingly recognized as a multifunctional material for agricultural and environmental applications. Three novel magnetic biochars (MOP250, MOP400, MOP700) were prepared by chemical co-precipitation of Fe3+/Fe2+ on orange peel powder and subsequently pyrolyzing under
Avi Cagan et al.
The Analyst, 133(5), 585-587 (2008-04-23)
A highly selective and rapid electrochemical assay of the improvised explosive urea nitrate (UN) is reported. The method involves a short ( approximately 10 s) acid-catalyzed reaction of UN with 4-nitrotoluene (NT) followed by a rapid ( approximately 2 s)

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