Skip to Content
Merck
All Photos(1)

Documents

31568

Supelco

4-Nitrotoluene

PESTANAL®, analytical standard

Synonym(s):

1-Methyl-4-nitrobenzene

Sign Into View Organizational & Contract Pricing
All Photos(1)

About This Item

Linear Formula:
CH3C6H4NO2
CAS Number:
99-99-0
Molecular Weight:
137.14
Beilstein:
1906911
EC Number:
202-808-0
MDL number:
MFCD00007366
UNSPSC Code:
41116107
PubChem Substance ID:
329753821

grade

analytical standard

vapor density

4.7 (vs air)

vapor pressure

5 mmHg ( 85 °C)

product line

PESTANAL®

autoignition temp.

734 °F

shelf life

limited shelf life, expiry date on the label

technique(s)

HPLC: suitable
gas chromatography (GC): suitable

bp

238 °C (lit.)

mp

52-54 °C (lit.)

density

1.392 g/mL at 25 °C (lit.)

application(s)

environmental

format

neat

SMILES string

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

Looking for similar products? Visit Product Comparison Guide

Application

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Legal Information

PESTANAL is a registered trademark of Merck KGaA, Darmstadt, Germany

Signal Word

Danger

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Aquatic Chronic 2 - STOT RE 2

Storage Class Code

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

WGK

WGK 3

Flash Point(F)

222.8 °F - closed cup

Flash Point(C)

106.00 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Choose from one of the most recent versions:

Certificates of Analysis (COA)

Lot/Batch Number
SZBD077XV
SZBA050XV
SZBA050X
SZE5067X

Don't see the Right Version?

If you require a particular version, you can look up a specific certificate by the Lot or Batch number.

Search for a COA

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

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)
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
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
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
Muhammet Erkan Kose et al.
The journal of physical chemistry. B, 110(29), 14032-14034 (2006-07-21)
The photoluminescence from functionalized single-walled carbon nanotubes was found to be highly sensitive to the presence of nitroaromatic compounds such as nitrobenzene, 4-nitrotoluene, and 2,4-dinitrotoluene. The strong luminescence quenching in solution was at the upper limit of diffusion-control and also
View All Related Papers

Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.

Contact Technical Service