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7496-02-8

7496-02-8 | 6-NITROCHRYSENE

CAS No: 7496-02-8 Catalog No: AG00G2JB MDL No:

Product Description

Catalog Number:
AG00G2JB
Chemical Name:
6-NITROCHRYSENE
CAS Number:
7496-02-8
IUPAC Name:
6-nitrochrysene
InChI:
InChI=1S/C18H11NO2/c20-19(21)18-11-17-13-6-2-1-5-12(13)9-10-15(17)14-7-3-4-8-16(14)18/h1-11H
InChI Key:
UAWLTQJFZUYROA-UHFFFAOYSA-N
UNII:
82ZK83O33Y
NSC Number:
407609

Properties

Complexity:
405  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.079g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.291g/mol
Monoisotopic Mass:
273.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5  

Literature

Title Journal
Mechanistic Investigations Into the Developmental Toxicity of Nitrated and Heterocyclic PAHs. Toxicological sciences : an official journal of the Society of Toxicology 20170501
Tumour-promoting activity of polycyclic aromatic hydrocarbons and their oxygenated or nitrated derivatives. Mutagenesis 20160301
Purge-assisted headspace solid-phase microextraction combined with gas chromatography/mass spectrometry for the determination of trace nitrated polycyclic aromatic hydrocarbons in aqueous samples. Journal of chromatography. A 20121123
Metabolic activation of diesel exhaust carcinogens in primary and immortalized human TP53 knock-in (Hupki) mouse embryo fibroblasts. Environmental and molecular mutagenesis 20120401
Inefficient nucleotide excision repair in human cell extracts of the N-(deoxyguanosin-8-yl)-6-aminochrysene and 5-(deoxyguanosin-N(2)-yl)-6-aminochrysene adducts derived from 6-nitrochrysene. Chemical research in toxicology 20110114
Bioaccumulation of nitroarenes in bivalves at Osaka Bay, Japan. Marine pollution bulletin 20110101
Nitroarenes (selected): 6-Nitrochrysene. Report on carcinogens : carcinogen profiles 20110101
RAS Mutations and Oncogenesis: Not all RAS Mutations are Created Equally. Frontiers in genetics 20110101
A novel approach for a toxicity prediction model of environmental pollutants by using a quantitative structure-activity relationship method based on toxicogenomics. ISRN toxicology 20110101
Stereoselective metabolism of the environmental mammary carcinogen 6-nitrochrysene to trans-1,2-dihydroxy-1,2-dihydro-6-nitrochrysene by aroclor 1254-treated rat liver microsomes and their comparative mutation profiles in a laci mammary epithelial cell line. Chemical research in toxicology 20091201
1-Nitropyrene stabilizes the mRNA of cytochrome P450 1a1, a carcinogen-metabolizing enzyme, via the Akt pathway. Chemical research in toxicology 20091201
Biological Basis of Differential Susceptibility to Hepatocarcinogenesis among Mouse Strains. Journal of toxicologic pathology 20090301
Comparative mutational profiles of the environmental mammary carcinogen, 6-nitrochrysene and its metabolites in a lacI mammary epithelial cell line. Carcinogenesis 20071101
Effects of the environmental mammary carcinogen 6-nitrochrysene on p53 and p21(Cip1) protein expression and cell cycle regulation in MCF-7 and MCF-10A cells. Chemico-biological interactions 20071020
Polycyclic aromatic hydrocarbons (PAHs), nitrated PAHs and oxygenated PAHs in ambient air of the Marseilles area (South of France): concentrations and sources. The Science of the total environment 20071001
Analytical method for determination of dinitropyrenes using gas chromatography-high-resolution mass spectrometry. Journal of chromatography. A 20070720
Singlet excited-state dynamics of nitropolycyclic aromatic hydrocarbons: direct measurements by femtosecond fluorescence up-conversion. The journal of physical chemistry. A 20070201
Vibrational and surface-enhanced vibrational spectra of 6-nitrochrysene. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20050114
Identification of 5-(deoxyguanosin-N2-yl)- 1,2-dihydroxy-1,2-dihydro-6-aminochrysene as the major DNA lesion in the mammary gland of rats treated with the environmental pollutant 6-nitrochrysene. Chemical research in toxicology 20041201
Derivatised carbon powder electrodes: reagentless pH sensors. Talanta 20040708
Mammary carcinogenesis and molecular analysis of in vivo cII gene mutations in the mammary tissue of female transgenic rats treated with the environmental pollutant 6-nitrochrysene. Carcinogenesis 20040401
Nitroarenes (selected) 6-nitrochrysene. Report on carcinogens : carcinogen profiles 20040101
Analysis of 6-(2,2-Dichloroacetamido)chrysene interaction with the hypoxanthine phosphoribosyltransferase from Trypanosoma cruzi. Journal of medicinal chemistry 20030605
Improvement of an automatic HPLC system for nitropolycyclic aromatic hydrocarbons: removal of an interfering peak and increase in the number of analytes. Analytical sciences : the international journal of the Japan Society for Analytical Chemistry 20030201
Metabolism and DNA binding of the environmental pollutant 6-nitrochrysene in primary culture of human breast cells and in cultured MCF-10A, MCF-7 and MDA-MB-435s cell lines. International journal of cancer 20020801
Comparative tumorigenicity of the environmental pollutant 6-nitrochrysene and its metabolites in the rat mammary gland. Chemical research in toxicology 20020701
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
Ploidy differences between hormone- and chemical carcinogen-induced rat mammary neoplasms: comparison to invasive human ductal breast cancer. Molecular carcinogenesis 20020101
Characterization of a major aromatic DNA adduct detected in human breast tissues. Environmental and molecular mutagenesis 20020101
Nitroarenes (selected). 6-Nitrochrysene. Report on carcinogens : carcinogen profiles 20020101
Cytochrome P450 induction by nitrated polycyclic aromatic hydrocarbons, azaarenes, and binary mixtures in fish hepatoma cell line PLHC-1. Environmental toxicology and chemistry 20010101
Tumorigenicity of nitropolycyclic aromatic hydrocarbons in the neonatal B6C3F1 mouse bioassay and characterization of ras mutations in liver tumors from treated mice. Cancer letters 19991101
Induction of cytochrome P450 1A in hamster liver and lung by 6-nitrochrysene. Archives of toxicology 19980601
Tumorigenicity of nitrated derivatives of pyrene, benz[a]anthracene, chrysene and benzo[a]pyrene in the newborn mouse assay. Carcinogenesis 19860801
Nitration of carcinogenic and non-carcinogenic polycyclic aromatic hydrocarbons results in products able to induce transformation of Syrian hamster cells. Carcinogenesis 19830101

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