1-nitropyrene (CAS 5522-43-0) — formula C16H9NO2, molecular weight 247.25; category organic chemicals.
| CAS Number | 5522-43-0 |
|---|---|
| Molecular Formula | C16H9NO2 |
| Molecular Weight | 247.25 |
| Melting Point | 155 °C |
| LogP | log Kow= 5.06 |
| Applications | Uses: Found in particulates in emissions from combustion, e.g., diesel exhausts, Used as a research chemical and produced by one company as an intermediate for 1-azidopyrene, used in photosenistive printing, [NTP], Research chemical, One Japanese company has been reported to use 1-nitropyrene as an intermediate in the production of 1-azidopyrene, which is used in photosensitive printing., Methods of Manufacturing: This compound has been synthesized by heating pyrene with nitric acid in acetic acid at 50 °C (Boit, 1965)., Impurities: 1-Nitropyrene is available for research purposes at 97% (Aldrich Chemical Co., 1988) or greater than or equal to 95% purity with less than or equal to 0.1% total dinitropyrenes and pyrene (Chemsyn Science Laboratories, 1988)., General Manufacturing Information: Pyrene, 1-nitro-: ACTIVE, No evidence was found that 1-nitropyrene has been produced in commercial quantities in the USA. One US company is reported to have processed an unspecified amount of 1-nitropyrene in 1977. |
| Category | Organic Chemicals |
Documented applications: Uses: Found in particulates in emissions from combustion, e.g., diesel exhausts, Used as a research chemical and produced by one company as an intermediate for 1-azidopyrene, used in photosenistive printing, [NTP], Research chemical, One Japanese company has been reported to use 1-nitropyrene as an intermediate in the production of 1-azidopyrene, which is used in photosensitive printing., Methods of Manufacturing: This compound has been synthesized by heating pyrene with nitric acid in acetic acid at 50 °C (Boit, 1965)., Impurities: 1-Nitropyrene is available for research purposes at 97% (Aldrich Chemical Co., 1988) or greater than or equal to 95% purity with less than or equal to 0.1% total dinitropyrenes and pyrene (Chemsyn Science Laboratories, 1988)., General Manufacturing Information: Pyrene, 1-nitro-: ACTIVE, No evidence was found that 1-nitropyrene has been produced in commercial quantities in the USA. One US company is reported to have processed an unspecified amount of 1-nitropyrene in 1977..
1-nitropyrene is a carbon-based organic compound with CAS registry number 5522-43-0 and molecular formula C16H9NO2 (molecular weight 247.25), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5522-43-0
Its molecular formula C16H9NO2 comprises 16 C, 9 H, 1 N, 2 O atoms.
Also known as: 1-nitropyrene · 1-硝基芘
Category: organic chemicals
The CAS registry number of 1-nitropyrene is 5522-43-0.
Molecular formula C16H9NO2, molecular weight 247.25.
It is also registered under: 1-nitropyrene, 1-硝基芘.
Recorded applications: Uses: Found in particulates in emissions from combustion, e.g., diesel exhausts, Used as a research chemical and produced by one company as an intermediate for 1-azidopyrene, used in photosenistive printing, [NTP], Research chemical, One Japanese company has been reported to use 1-nitropyrene as an intermediate in the production of 1-azidopyrene, which is used in photosensitive printing., Methods of Manufacturing: This compound has been synthesized by heating pyrene with nitric acid in acetic acid at 50 °C (Boit, 1965)., Impurities: 1-Nitropyrene is available for research purposes at 97% (Aldrich Chemical Co., 1988) or greater than or equal to 95% purity with less than or equal to 0.1% total dinitropyrenes and pyrene (Chemsyn Science Laboratories, 1988)., General Manufacturing Information: Pyrene, 1-nitro-: ACTIVE, No evidence was found that 1-nitropyrene has been produced in commercial quantities in the USA. One US company is reported to have processed an unspecified amount of 1-nitropyrene in 1977..
Category: Organic Chemicals.
Independent reference data for 1-nitropyrene (CAS 5522-43-0), compiled from public chemistry databases.
| CAS Registry Number | 5522-43-0 |
|---|---|
| PubChem CID | 21694 |
| Molecular formula | C16H9NO2 |
| IUPAC name | 1-nitropyrene |
| UNII (FDA) | TD1665I8Q4 |
| Molecular Weight | 247.25 |
|---|---|
| XLogP3 | 5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 247.063328530 |
| Monoisotopic Mass | 247.063328530 |
| Topological Polar Surface Area | 45.8 |
| Heavy Atom Count | 19 |
| Melting Point | 155 °C |
|---|---|
| Solubility | In water, 0.0118 mg/l @ 25 °C |
| Vapor Pressure | 0.00000006 [mmHg] |
| LogP | log Kow= 5.06 |
| LogP | 5.06 |
1-NITROPYRENE; 5522-43-0; 3-Nitropyrene; Pyrene, 1-nitro-; DTXSID6020983; TD1665I8Q4; NSC-81340; DTXCID40983; CHEBI:34107; NSC81340; RefChem:435072; 226-868-2; Pyrene, nitro-; NITROPYRENE; MFCD00004138; 63021-86-3
| Reported hazard statements | H341 (22.8%), H351 (98.2%), H400, H410, H350, H372 |
|---|
H341 (22.8%): Suspected of causing genetic defects [Warning Germ cell mutagenicity]
H351 (98.2%): Suspected of causing cancer [Warning Carcinogenicity]
1-nitropyrene · CAS 5522-43-0 · C16H9NO2. UNII TD1665I8Q4. Melting Point: 155 °C; Solubility: In water, 0.0118 mg/l @ 25 °C; Vapor Pressure: 0.00000006 [mmHg].
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 1-硝基芘