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42397-65-9

42397-65-9 | 1,8-Dinitropyrene

CAS No: 42397-65-9 Catalog No: AG003DS6 MDL No:

Product Description

Catalog Number:
AG003DS6
Chemical Name:
1,8-Dinitropyrene
CAS Number:
42397-65-9
IUPAC Name:
1,8-dinitropyrene
InChI:
InChI=1S/C16H8N2O4/c19-17(20)13-7-3-9-1-2-10-4-8-14(18(21)22)12-6-5-11(13)15(9)16(10)12/h1-8H
InChI Key:
BLYXNIHKOMELAP-UHFFFAOYSA-N
UNII:
51U7E9MW6I

Properties

Complexity:
442  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.048g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.25g/mol
Monoisotopic Mass:
292.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  

Literature

Title Journal
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Classification of polycyclic aromatic hydrocarbons based on mutagenicity in lung tissue through DNA microarray. Environmental toxicology 20131101
A new imidazolium-embedded C18 stationary phase with enhanced performance in reversed-phase liquid chromatography. Analytica chimica acta 20120813
Environmental nitration processes enhance the mutagenic potency of aromatic compounds. Environmental toxicology 20120501
Metabolic activation of diesel exhaust carcinogens in primary and immortalized human TP53 knock-in (Hupki) mouse embryo fibroblasts. Environmental and molecular mutagenesis 20120401
Genetic requirement for mutagenesis of the G[8,5-Me]T cross-link in Escherichia coli: DNA polymerases IV and V compete for error-prone bypass. Biochemistry 20110329
Nitroarenes (selected): 1,8-Dinitropyrene. Report on carcinogens : carcinogen profiles 20110101
Mutagenicity of surface soil from residential areas in Kyoto city, Japan, and identification of major mutagens. Mutation research 20080108
Mutagenicity of the 1-nitropyrene-DNA adduct N-(deoxyguanosin-8-yl)-1-aminopyrene in mammalian cells. Chemical research in toxicology 20071101
Effects of nitrated-polycyclic aromatic hydrocarbons and diesel exhaust particle extracts on cell signalling related to apoptosis: possible implications for their mutagenic and carcinogenic effects. Toxicology 20070307
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods. Journal of molecular graphics & modelling 20061101
Nitrocompound activation by cell-free extracts of nitroreductase-proficient Salmonella typhimurium strains. Mutagenesis 20061101
Detection of a novel mutagen, 3,6-dinitrobenzo[e]pyrene, as a major contaminant in surface soil in Osaka and Aichi Prefectures, Japan. Chemical research in toxicology 20050201
Oxidative DNA damage induced by carcinogenic dinitropyrenes in the presence of P450 reductase. Chemical research in toxicology 20041201
Nitroarenes (selected) 1,8-dinitropyrene. Report on carcinogens : carcinogen profiles 20040101
Mutagenic activity and quantification of nitroarenes in surface soil in the Kinki region of Japan. Mutation research 20030708
Comparative mutagenesis of the C8-guanine adducts of 1-nitropyrene and 1,6- and 1,8-dinitropyrene in a CpG repeat sequence. A slipped frameshift intermediate model for dinucleotide deletion. The Journal of biological chemistry 20021122
Induction of CYP1A1, CYP1A2, and CYP1B1 mRNAs by nitropolycyclic aromatic hydrocarbons in various human tissue-derived cells: chemical-, cytochrome P450 isoform-, and cell-specific differences. Archives of toxicology 20020601
Dinitropyrenes induce gene mutations in multiple organs of the lambda/lacZ transgenic mouse (Muta Mouse). Mutation research 20020325
Induction of sister chromatid exchanges and chromosome aberrations in cultured mammalian cells treated with aminophenylnorharman formed by norharman with aniline. Mutation research 20020325
Nitroarenes (selected). 1,8-Dinitropyrene. Report on carcinogens : carcinogen profiles 20020101
Catechins are not major components responsible for anti-genotoxic effects of tea extracts against nitroarenes. Mutation research 20010920
[Suppression of frameshift mutation as a result of partial inactivation of translation termination factors in Saccharomyces cerevisiae yeast]. Genetika 20010501
Bioactivation of diesel exhaust particle extracts and their major nitrated polycyclic aromatic hydrocarbon components, 1-nitropyrene and dinitropyrenes, by human cytochromes P450 1A1, 1A2, and 1B1. Mutation research 20001220
Carcinogenicity of nitropyrenes in the newborn female rat. Carcinogenesis 19951201
Decreased clastogenicity of dinitropyrenes in Chinese hamster lung (CHL) subclone cells with low NADPH-cytochrome P-450 reductase activity. Mutation research 19910901
Carcinogenicity of dinitropyrenes in the weanling female CD rat. Carcinogenesis 19910701
Purified NAD(P)H-quinone oxidoreductase enhances the mutagenicity of dinitropyrenes in vitro. Journal of biochemical toxicology 19910101
1,8-Dinitropyrene: comparative mutagenicity in Chinese hamster V79 and CHO cells. Mutagenesis 19900501
Inactivation of 1,3-, 1,6-, and 1,8-dinitropyrene by cytochrome P-450 enzymes in human and rat liver microsomes. Cancer research 19900401
Metabolism and biological effects of nitropyrene and related compounds. Research report (Health Effects Institute) 19880201
Tumorigenicity test of 1,3- and 1,8-dinitropyrene in BALB/c mice. Journal of the National Cancer Institute 19870701
Tumorigenicity of nitrated derivatives of pyrene, benz[a]anthracene, chrysene and benzo[a]pyrene in the newborn mouse assay. Carcinogenesis 19860801
Structure of the c-Ki-ras gene in a rat fibrosarcoma induced by 1,8-dinitropyrene. Molecular and cellular biology 19860401
Dinitro derivatives of pyrene and fluoranthene in diesel emission particulates and their tumorigenicity in mice and rats. Developments in toxicology and environmental science 19860101
Carcinogenic effects of a mixture of nitropyrenes in F344 rats following its repeated oral administrations. Developments in toxicology and environmental science 19860101
Induction of 6-thioguanine resistance, chromosome aberrations and SCE by dinitropyrenes in Chinese hamster ovary cells in vitro. Mutation research 19851201
Activation of K-ras and oncogenes other than ras family in rat fibrosarcomas induced by 1,8-dinitropyrene. Cancer letters 19851101
DNA adduct formation and mutation induction by nitropyrenes in Salmonella and Chinese hamster ovary cells: relationships with nitroreduction and acetylation. Environmental health perspectives 19851001
Absence of carcinogenicity of 1-nitropyrene, correction of previous results, and new demonstration of carcinogenicity of 1,6-dinitropyrene in rats. Cancer letters 19850101
Induction of sarcomas in rats by subcutaneous injection of dinitropyrenes. Carcinogenesis 19840501
Tumor initiating activities of 1-nitropyrene and its nitrated products in SENCAR mice. Cancer letters 19840501
Mutagenicity of mono-, di- and tri-nitropyrenes in Chinese hamster ovary cells. Mutation research 19830301
Nitration of carcinogenic and non-carcinogenic polycyclic aromatic hydrocarbons results in products able to induce transformation of Syrian hamster cells. Carcinogenesis 19830101
The clastogenic activity of dinitropyrenes in a rat-liver epithelial cell line. Mutation research 19821101

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