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| | 3-NITROFLUORANTHENE Basic information |
| | 3-NITROFLUORANTHENE Chemical Properties |
| Melting point | 157-159 °C (lit.) | | Boiling point | 390.29°C (rough estimate) | | density | 1.1699 (rough estimate) | | refractive index | 1.5300 (estimate) | | storage temp. | 2-8°C | | form | powder | | BRN | 2216474 | | Henry's Law Constant | 1.1×102 mol/(m3Pa) at 25℃, Parnis et al. (2015) | | 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 | | InChIKey | PIHGQKMEAMSUNA-UHFFFAOYSA-N | | SMILES | [O-][N+](=O)c1ccc2-c3ccccc3-c4cccc1c24 | | IARC | 3 (Vol. 33, Sup 7) 1987 | | EPA Substance Registry System | 3-Nitrofluoranthene (892-21-7) |
| Safety Statements | 24/25 | | WGK Germany | 3 | | RTECS | LL4750000 | | HS Code | 29042000 | | Storage Class | 11 - Combustible Solids |
| | 3-NITROFLUORANTHENE Usage And Synthesis |
| Chemical Properties | ORANGE POWDER | | Uses | 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. | | Definition | ChEBI: 3-Nitrofluoranthene is a nitronaphthalene. | | 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. | | Purification Methods | Recrystallise it from AcOH or EtOAc (yellow crystals) and/or sublime it at high vacuum. It is soluble in CH2Cl2, Me2CO or *C6H6, soluble in warm EtOH and very soluble in Et2O. [Kloetzel et al. J Am Chem Soc 78 1165 1956, Beilstein 5 III 2279.] |
| | 3-NITROFLUORANTHENE Preparation Products And Raw materials |
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