Cas no 1187164-50-6 (5-Methyl-2-(4-nitrobenzoyl)pyridine)
5-Methyl-2-(4-nitrobenzoyl)pyridine Chemical and Physical Properties
Names and Identifiers
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- 5-Methyl-2-(4-nitrobenzoyl)pyridine
- (5-Methylpyridin-2-yl)(4-nitrophenyl)methanone
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- MDL: MFCD13152661
- Inchi: 1S/C13H10N2O3/c1-9-2-7-12(14-8-9)13(16)10-3-5-11(6-4-10)15(17)18/h2-8H,1H3
- InChI Key: QIDDBVLHOKHYMF-UHFFFAOYSA-N
- SMILES: O=C(C1C=CC(C)=CN=1)C1C=CC(=CC=1)[N+](=O)[O-]
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 319
- Topological Polar Surface Area: 75.8
5-Methyl-2-(4-nitrobenzoyl)pyridine Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 202868-1g |
5-Methyl-2-(4-nitrobenzoyl)pyridine |
1187164-50-6 | 97% | 1g |
£554.00 | 2022-03-01 | |
| Fluorochem | 202868-2g |
5-Methyl-2-(4-nitrobenzoyl)pyridine |
1187164-50-6 | 97% | 2g |
£837.00 | 2022-03-01 | |
| Fluorochem | 202868-5g |
5-Methyl-2-(4-nitrobenzoyl)pyridine |
1187164-50-6 | 97% | 5g |
£1702.00 | 2022-03-01 | |
| Matrix Scientific | 086643-1g |
5-Methyl-2-(4-nitrobenzoyl)pyridine, 97% |
1187164-50-6 | 97% | 1g |
$517.00 | 2023-09-08 | |
| Matrix Scientific | 086643-2g |
5-Methyl-2-(4-nitrobenzoyl)pyridine, 97% |
1187164-50-6 | 97% | 2g |
$739.00 | 2023-09-08 | |
| Matrix Scientific | 086643-5g |
5-Methyl-2-(4-nitrobenzoyl)pyridine, 97% |
1187164-50-6 | 97% | 5g |
$1412.00 | 2023-09-08 | |
| Ambeed | A915950-1g |
(5-Methylpyridin-2-yl)(4-nitrophenyl)methanone |
1187164-50-6 | 97% | 1g |
$371.0 | 2024-04-25 | |
| abcr | AB362985-1 g |
5-Methyl-2-(4-nitrobenzoyl)pyridine, 97%; . |
1187164-50-6 | 97% | 1 g |
€954.60 | 2023-07-19 | |
| abcr | AB362985-2 g |
5-Methyl-2-(4-nitrobenzoyl)pyridine, 97%; . |
1187164-50-6 | 97% | 2 g |
€1,400.00 | 2023-07-19 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1781711-1g |
(5-Methylpyridin-2-yl)(4-nitrophenyl)methanone |
1187164-50-6 | 97% | 1g |
¥15288.00 | 2024-08-09 |
5-Methyl-2-(4-nitrobenzoyl)pyridine Related Literature
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
Additional information on 5-Methyl-2-(4-nitrobenzoyl)pyridine
Introduction to 5-Methyl-2-(4-nitrobenzoyl)pyridine (CAS No: 1187164-50-6)
5-Methyl-2-(4-nitrobenzoyl)pyridine, with the chemical formula C13H10N2O3, is a significant compound in the realm of pharmaceutical and chemical research. This compound, identified by its CAS number 1187164-50-6, has garnered attention due to its versatile applications in synthetic chemistry and potential roles in drug development. The structural integrity of this molecule, featuring a pyridine core substituted with a methyl group and a 4-nitrobenzoyl moiety, makes it a valuable intermediate in various chemical syntheses.
The utility of 5-Methyl-2-(4-nitrobenzoyl)pyridine stems from its unique reactivity, which allows it to participate in multiple chemical transformations. The presence of the nitro group and the benzoyl moiety enhances its compatibility with a range of functional groups, making it a pivotal building block in organic synthesis. Researchers have leveraged these properties to develop novel methodologies for constructing complex molecular architectures.
In recent years, the compound has been explored for its potential applications in medicinal chemistry. The pyridine ring is a common pharmacophore in many bioactive molecules, and modifications at the 5-position can significantly influence biological activity. Studies have shown that derivatives of this compound exhibit promising pharmacological properties, including antimicrobial and anti-inflammatory effects. These findings have spurred further investigation into the synthesis of analogs that may enhance therapeutic efficacy.
The synthesis of 5-Methyl-2-(4-nitrobenzoyl)pyridine involves multi-step organic reactions that highlight the compound's synthetic versatility. The process typically begins with the nitration of benzoyl chloride, followed by condensation with methylamine and subsequent functionalization at the pyridine ring. Advanced techniques such as palladium-catalyzed cross-coupling reactions have also been employed to optimize yield and purity. These synthetic strategies underscore the importance of this compound as a key intermediate in industrial and academic research.
Recent advancements in computational chemistry have further illuminated the potential of 5-Methyl-2-(4-nitrobenzoyl)pyridine. Molecular modeling studies have provided insights into its interactions with biological targets, aiding in the design of more effective drug candidates. The nitro group, in particular, has been found to modulate binding affinity through hydrogen bonding and electrostatic interactions. Such findings are crucial for rational drug design and highlight the compound's significance in modern pharmaceutical research.
The compound's role extends beyond synthetic intermediates; it also serves as a substrate for enzyme-mediated transformations. Enzymes such as cytochrome P450 oxidases can metabolize this molecule, providing valuable insights into drug metabolism and potential side effects. Understanding these metabolic pathways is essential for developing safer and more effective therapeutic agents. The integration of enzymology with synthetic chemistry has opened new avenues for drug discovery.
In conclusion, 5-Methyl-2-(4-nitrobenzoyl)pyridine (CAS No: 1187164-50-6) is a multifaceted compound with significant implications in pharmaceutical research. Its structural features enable diverse chemical transformations, making it a valuable tool for synthetic chemists. Moreover, its potential biological activities and metabolic interactions position it as a promising candidate for future drug development. As research continues to uncover new applications, this compound will undoubtedly remain at the forefront of chemical innovation.
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