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ERA-017

Supelco

2-Amino-4,6-dinitrotoluene

vial of 100 mg, analytical standard, Cerilliant®

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About This Item

Empirical Formula (Hill Notation):
C7H7N3O4
CAS Number:
35572-78-2
Molecular Weight:
197.15
MDL number:
MFCD00024526
UNSPSC Code:
41116107
PubChem Substance ID:
329799580
NACRES:
NA.24

grade

analytical standard

packaging

vial of 100 mg

manufacturer/tradename

Cerilliant®

application(s)

environmental
forensics and toxicology

format

neat

storage temp.

room temp

SMILES string

NC1=C(C)C([N+]([O-])=O)=CC([N+]([O-])=O)=C1

InChI

1S/C7H7N3O4/c1-4-6(8)2-5(9(11)12)3-7(4)10(13)14/h2-3H,8H2,1H3

InChI key

IEEJAAUSLQCGJH-UHFFFAOYSA-N

General description

2-Amino-4,6-dinitrotoluene is a metabolite of 2,4,6-trinitrotoluene, which is widely used as an explosive in military shells, bombs, and grenades.[1][2].

Application

2-Amino-4,6-dinitrotoluene may be used as a standard for the determination of the analyte in explosive residues, ammunition waste and sewage water samples by chromatography[1][2] and mass spectrometry[3] techniques.

Legal Information

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

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Danger

Hazard Classifications

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

Storage Class

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

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

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Determination of 2, 4, 6-Trinitrotoluene in Wastes and Sewage Water from Mining Industry by Chromato-Mass Spectrometry
Zhuravlyov NV, et al.
Eurasian Chemico-Technological Journal, 15(4), 307-311 (2013)
Alethea T Bowen et al.
Chemosphere, 63(1), 58-63 (2005-12-06)
Tubifex tubifex metabolizes 2,4,6-trinitrotoluene (TNT) to 2-amino-4,6-dinitrotoluene (2ADNT) and 4-amino-2,6-dinitrotoluene (4ADNT). Elimination rates of metabolically-generated ADNTs are low compared to ADNTs absorbed directly from water, suggesting that metabolically-generated ADNTs may be bound or sequestered within tissue and therefore less available
Qualitative and quantitative determination of 2, 4, 6-TNT, hexogen, octogen, aminonitro-and nitrocompounds in ammunition wastes with modified TLC and HPTLC precoated layers
Kessel S and Hauck HE
Chromatographia, 43(7-8), 401-404 (1996)
L R Krumholz et al.
Journal of industrial microbiology & biotechnology, 18(2-3), 161-169 (1997-02-01)
The transport and fate of pollutants is often governed by both their tendency to sorb as well as their susceptibility to biodegradation. We have evaluated these parameters for 2,4,6-trinitrotoluene (TNT) and several biodegradation products. Slurries of aquifer sediment and groundwater
B Van Aken et al.
Applied microbiology and biotechnology, 54(5), 659-664 (2000-12-29)
Manganese-dependent peroxidase (MnP) H5 from the white-rot fungus Phanerochaete chrysosporium, in the presence of either Mn(II) (10 mM) or GSH (10 mM). was able to mineralize 14C-U-ring-labeled 2-amino-4,6-dinitrotoluene (2-A-4,6-DNT) up to 29% in 12 days. When both Mn(II) and GSH
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