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405604

Sigma-Aldrich

3-Nitrofluoranthene

technical grade, 90%

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About This Item

Empirical Formula (Hill Notation):
C16H9NO2
CAS Number:
Molecular Weight:
247.25
Beilstein:
2216474
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

grade

technical grade

Assay

90%

form

powder

mp

157-159 °C (lit.)

functional group

nitro

SMILES string

[O-][N+](=O)c1ccc2-c3ccccc3-c4cccc1c24

InChI

1S/C16H9NO2/c18-17(19)15-9-8-13-11-5-2-1-4-10(11)12-6-3-7-14(15)16(12)13/h1-9H

InChI key

PIHGQKMEAMSUNA-UHFFFAOYSA-N

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General description

3-Nitrofluoranthene (3-NFA) is a nitro-polycyclic aromatic hydrocarbon (nitro-PAH). It is an air pollutant present in diesel exhaust and also in some xerographic toners and copies. Vibrational spectra of 3-NFA has been analyzed by FT-IR and density functional theory calculations. Detection of 3-NFA in suspended particulate matter has been reported by liquid chromatography with fluorescence detection. Carcinogenicity of 3-nitrofluoranthene in male F344/DuCrj rats has been studied. Voltammetric determination of 3-nitrofluoranthene in mixed methanol-water solutions by differential pulse voltammetry (DPV) at boron doped diamond thin-film electrode (BDDE) has been described. Analysis of 3-nitrofluoranthene, by HPLC separation and with electrochemiluminescence detection (ECL) has been reported.

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Electrochemiluminescence determination of nitro polycyclic-aromatic hydrocarbons using HPLC separation.
Chen X, et al.
Chromatographia, 58(9-10), 571-577 (2003)
Shan-Hong Lan et al.
Environmental science and pollution research international, 21(12), 7390-7399 (2014-03-01)
Total suspended and size-segregated atmospheric particles were collected in four seasons at three representative points in different functional areas of Dongguan City. The detailed size distributions of six nitro-PAHs [2-nitrofluorene (2-NF), 9-nitroanthracene, 2-nitrofluoranthene (2-NFL), 3-nitrofluoranthene, 1-nitropyrene, and 2-nitropyrene (2-NP)] were
Voltammetric Determination of 3-Nitrofluoranthene and 3-Aminofluoranthene at Boron Doped Diamond Thin-Film Electrode.
Cizek K, et al.
Electroanalysis, 19(12), 1295-1299 (2007)
H Ohgaki et al.
Cancer letters, 15(1), 1-7 (1982-01-01)
1-Nitropyrene and 3-nitrofluoranthene are present in diesel exhaust, in pollutants in air, and were also present in certain xerographic toners and copies. Their carcinogenicities were studied in male F344/DuCrj rats by subcutaneous injection. Sarcomas, mainly malignant fibrous histiocytomas at the
Experimental and theoretical study of vibrational spectra of 3-nitrofluoranthene.
Onchoke KK and Parks M.
Journal of Molecular Structure, 999(1), 22-28 (2011)

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