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Home > Nitro Compounds > 13980-04-6
13980-04-6 | 1,3,5-Triazine, hexahydro-1,3,5-trinitroso-
CAS No: 13980-04-6 Catalog No: AG001BPZ MDL No:
Product Description
Catalog Number:
AG001BPZ
Chemical Name:
1,3,5-Triazine, hexahydro-1,3,5-trinitroso-
CAS Number:
13980-04-6
Molecular Formula:
C3H6N6O3
Molecular Weight:
174.1181
IUPAC Name:
1,3,5-trinitroso-1,3,5-triazinane
InChI:
InChI=1S/C3H6N6O3/c10-4-7-1-8(5-11)3-9(2-7)6-12/h1-3H2
InChI Key:
HFWOSHMLDRSIDN-UHFFFAOYSA-N
SMILES:
O=NN1CN(N=O)CN(C1)N=O
EC Number:
237-766-2
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.05g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.12g/mol
Monoisotopic Mass:
174.05g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
98A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
Literature
| Title | Journal |
|---|---|
| Biodegradation of RDX nitroso products MNX and TNX by cytochrome P450 XplA. | Environmental science & technology 20120703 |
| Peromyscus as a Mammalian epigenetic model. | Genetics research international 20120101 |
| Engineering plants for the phytoremediation of RDX in the presence of the co-contaminating explosive TNT. | The New phytologist 20111001 |
| Uptake, bioaccumulation, and biodegradation of hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX) and its reduced metabolites (MNX and TNX) by the earthworm (Eisenia fetida). | Chemosphere 20090601 |
| Multigenerational effects in deer mice (Peromyscus maniculatus) exposed to hexahydro-1,3,5-trinitroso-1,3,5-triazine (TNX). | Chemosphere 20090501 |
| Effect of two major N-nitroso hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX) metabolites on earthworm reproductive success. | Environmental pollution (Barking, Essex : 1987) 20080601 |
| Abiotic transformation of hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX) by green rusts. | Environmental science & technology 20080601 |
| Regulation of hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX) metabolism in Shewanella halifaxensis HAW-EB4 by terminal electron acceptor and involvement of c-type cytochrome. | Microbiology (Reading, England) 20080401 |
| Metabolite profiling of [14C]hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX) in Yucatan miniature pigs. | Journal of toxicology and environmental health. Part A 20070701 |
| Age dependent acute oral toxicity of hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX) and two anaerobic N-nitroso metabolites in deer mice (Peromyscus maniculatus). | Chemosphere 20070501 |
| Extraction and determination of trace amounts of energetic compounds in blood by gas chromatography with electron capture detection (GC/ECD). | Talanta 20070430 |
| Examination of the mutagenicity of RDX and its N-nitroso metabolites using the Salmonella reverse mutation assay. | Mutation research 20070420 |
| N-Nitroso compounds produced in deer mouse (Peromyscus maniculatus) GI tracts following hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX) exposure. | Chemosphere 20070401 |
| Effects of hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX) metabolites on cricket (Acheta domesticus) survival and reproductive success. | Environmental pollution (Barking, Essex : 1987) 20061101 |
| Biodegradation of hexahydro-1,3,5-trinitro-1,3,5-triazine by novel fungi isolated from unexploded ordnance contaminated marine sediment. | Journal of industrial microbiology & biotechnology 20061001 |
| Toxicity of the explosive metabolites hexahydro-1,3,5-trinitroso-1,3,5-triazine (TNX) and hexahydro-1-nitroso-3,5-dinitro-1,3,5-triazine (MNX) to the earthworm Eisenia fetida. | Chemosphere 20060601 |
| Determination of N-nitroso derivatives of hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX) in soils by pressurized liquid extraction and liquid chromatography-electrospray ionization mass spectrometry. | Journal of chromatography. A 20060224 |
| Reproductive effects of hexahydro-1,3,5-trinitroso-1,3,5-triazine in deer mice (Peromyscus maniculatus) during a controlled exposure study. | Environmental toxicology and chemistry 20060201 |
| Evaluating the bioavailability of explosive metabolites, hexahydro-1-nitroso-3,5-dinitro-1,3,5-triazine (MNX) and hexahydro-1,3,5-trinitroso-1,3,5-triazine (TNX), in soils using passive sampling devices. | Journal of chromatography. A 20060106 |
| Extraction and analysis of trace amounts of cyclonite (RDX) and its nitroso-metabolites in animal liver tissue using gas chromatography with electron capture detection (GC-ECD). | Talanta 20051015 |
| Use of pressurized liquid extraction (PLE)/gas chromatography-electron capture detection (GC-ECD) for the determination of biodegradation intermediates of hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX) in soils. | Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20050925 |
| Thermal reactivity of some nitro- and nitroso-compounds derived from 1,3,5,7-tetraazabicyclo[3.3.1]nonane at contamination by ammonium nitrate. | Journal of hazardous materials 20050520 |
| Up-and-down procedure (UDP) determinations of acute oral toxicity of nitroso degradation products of hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX). | Journal of applied toxicology : JAT 20050101 |
| [Introduction to hepatitis A]. | Nihon rinsho. Japanese journal of clinical medicine 20040801 |
| Metabolism of hexahydro-1,3,5-trinitro-1,3,5-triazine through initial reduction to hexahydro-1-nitroso-3,5-dinitro-1,3,5-triazine followed by denitration in Clostridium bifermentans HAW-1. | Applied microbiology and biotechnology 20031201 |
| Hexahydro-1,3,5-trinitro-1,3,5-triazine mineralization by zerovalent iron and mixed anaerobic cultures. | Environmental science & technology 20011101 |
| The fate of the cyclic nitramine explosive RDX in natural soil. | Environmental science & technology 20010315 |
| Detection of the cyclic nitramine explosives hexahydro-1,3,5-trinitro- 1,3,5-triazine (RDX) and octahydro- 1,3,5,7-tetranitro- 1,3,5,7-tetrazine (HMX) and their degradation products in soil environments. | Journal of chromatography. A 20010209 |
| Use of a Salmonella microsuspension bioassay to detect the mutagenicity of munitions compounds at low concentrations. | Mutation research 20010125 |
| Characterization of metabolites during biodegradation of hexahydro-1, 3,5-trinitro-1,3,5-triazine (RDX) with municipal anaerobic sludge. | Applied and environmental microbiology 20000601 |
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