Cas no 1000512-13-9 (3-(2-chloropyridin-3-yl)propan-1-amine)
3-(2-chloropyridin-3-yl)propan-1-amine Chemical and Physical Properties
Names and Identifiers
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- 3-(2-chloropyridin-3-yl)propan-1-amine
- EN300-1965937
- AB55105
- 1000512-13-9
- AKOS006314338
-
- MDL: MFCD09913202
- Inchi: 1S/C8H11ClN2/c9-8-7(3-1-5-10)4-2-6-11-8/h2,4,6H,1,3,5,10H2
- InChI Key: FAPMQWXGSPCOHK-UHFFFAOYSA-N
- SMILES: ClC1C(=CC=CN=1)CCCN
Computed Properties
- Exact Mass: 170.0610761Da
- Monoisotopic Mass: 170.0610761Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 108
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.5
- Topological Polar Surface Area: 38.9?2
Experimental Properties
- PSA: 38.91000
- LogP: 2.32660
3-(2-chloropyridin-3-yl)propan-1-amine Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Enamine | EN300-1965937-1g |
3-(2-chloropyridin-3-yl)propan-1-amine |
1000512-13-9 | 1g |
$1172.0 | 2023-09-17 | ||
| Enamine | EN300-1965937-5g |
3-(2-chloropyridin-3-yl)propan-1-amine |
1000512-13-9 | 5g |
$3396.0 | 2023-09-17 | ||
| Enamine | EN300-1965937-10g |
3-(2-chloropyridin-3-yl)propan-1-amine |
1000512-13-9 | 10g |
$5037.0 | 2023-09-17 | ||
| Enamine | EN300-1965937-0.05g |
3-(2-chloropyridin-3-yl)propan-1-amine |
1000512-13-9 | 0.05g |
$983.0 | 2023-09-17 | ||
| Enamine | EN300-1965937-0.1g |
3-(2-chloropyridin-3-yl)propan-1-amine |
1000512-13-9 | 0.1g |
$1031.0 | 2023-09-17 | ||
| Enamine | EN300-1965937-0.25g |
3-(2-chloropyridin-3-yl)propan-1-amine |
1000512-13-9 | 0.25g |
$1078.0 | 2023-09-17 | ||
| Enamine | EN300-1965937-0.5g |
3-(2-chloropyridin-3-yl)propan-1-amine |
1000512-13-9 | 0.5g |
$1124.0 | 2023-09-17 | ||
| Enamine | EN300-1965937-1.0g |
3-(2-chloropyridin-3-yl)propan-1-amine |
1000512-13-9 | 1g |
$1172.0 | 2023-05-31 | ||
| Enamine | EN300-1965937-2.5g |
3-(2-chloropyridin-3-yl)propan-1-amine |
1000512-13-9 | 2.5g |
$2295.0 | 2023-09-17 | ||
| Enamine | EN300-1965937-5.0g |
3-(2-chloropyridin-3-yl)propan-1-amine |
1000512-13-9 | 5g |
$3396.0 | 2023-05-31 |
3-(2-chloropyridin-3-yl)propan-1-amine Related Literature
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
Additional information on 3-(2-chloropyridin-3-yl)propan-1-amine
3-(2-Chloropyridin-3-yl)propan-1-amine (CAS No. 1000512-13-9): A Versatile Building Block in Modern Chemistry
3-(2-Chloropyridin-3-yl)propan-1-amine (CAS No. 1000512-13-9) is an important chloropyridine derivative that has gained significant attention in pharmaceutical and agrochemical research. This amine-functionalized pyridine compound serves as a crucial chemical intermediate for the synthesis of various biologically active molecules. The presence of both chloropyridine moiety and propylamine chain makes this compound particularly valuable for drug discovery and material science applications.
The molecular structure of 3-(2-chloropyridin-3-yl)propan-1-amine features a pyridine ring substituted at the 3-position with a 3-aminopropyl group and at the 2-position with a chlorine atom. This unique arrangement provides multiple sites for chemical modification, making it a versatile building block in organic synthesis. Researchers particularly value its potential in creating heterocyclic compounds with potential biological activity.
In recent years, 3-(2-chloropyridin-3-yl)propan-1-amine derivatives have been investigated for their potential in addressing current global health challenges. The COVID-19 pandemic has heightened interest in pyridine-based compounds as potential antiviral agents, with researchers exploring their interactions with viral proteins. While not directly therapeutic itself, this chemical scaffold serves as a foundation for developing novel small molecule drugs targeting various diseases.
The agrochemical industry has shown growing interest in chloropyridine amines like 1000512-13-9 due to their potential in developing new generation crop protection agents. With increasing concerns about food security and sustainable agriculture, compounds based on this pyridine amine structure are being evaluated for their herbicidal and insecticidal properties. The 2-chloro-3-substituted pyridine framework is particularly promising for creating selective pesticides with reduced environmental impact.
From a synthetic chemistry perspective, 3-(2-chloropyridin-3-yl)propan-1-amine offers several advantages. The amine functionality allows for easy conjugation with various carboxylic acids and carbonyl compounds, while the chloropyridine group enables cross-coupling reactions such as Suzuki-Miyaura and Buchwald-Hartwig couplings. These characteristics make it valuable for combinatorial chemistry approaches in drug discovery.
Material scientists have begun exploring applications of 1000512-13-9 in advanced materials. The compound's ability to form coordination complexes with metals makes it potentially useful for creating functional materials with specific electronic or optical properties. Recent studies suggest possible applications in organic electronics and catalysis, particularly in developing more efficient photocatalysts for sustainable chemistry applications.
The synthesis of 3-(2-chloropyridin-3-yl)propan-1-amine typically involves nucleophilic substitution reactions starting from appropriate pyridine precursors. Modern synthetic approaches emphasize atom economy and green chemistry principles, reflecting the growing importance of sustainable practices in chemical manufacturing. Process optimization continues to be an active area of research to improve yields and reduce environmental impact.
Analytical characterization of CAS 1000512-13-9 employs standard techniques including NMR spectroscopy, mass spectrometry, and HPLC analysis. The compound typically appears as a light yellow to colorless liquid at room temperature, with solubility properties that vary significantly between polar and non-polar solvents. These physical characteristics are important considerations for its handling and application in various chemical processes.
Regulatory aspects of 3-(2-chloropyridin-3-yl)propan-1-amine production and use continue to evolve with increasing chemical safety standards. Manufacturers and researchers must comply with REACH regulations and other regional chemical control frameworks. Proper risk assessment and safety protocols are essential when working with this compound, particularly regarding its handling, storage, and disposal.
The commercial availability of 1000512-13-9 has expanded in recent years to meet growing demand from pharmaceutical and agrochemical developers. Suppliers typically offer this chemical intermediate in various purity grades, with 98% purity being common for research applications. Pricing trends reflect the compound's increasing importance in specialty chemical markets.
Future research directions for 3-(2-chloropyridin-3-yl)propan-1-amine include exploration of its structure-activity relationships in medicinal chemistry and further development of efficient synthetic routes. The compound's potential in addressing current challenges in drug resistance and sustainable agriculture makes it particularly relevant to contemporary research priorities. Its versatility ensures it will remain an important chemical building block for years to come.
Environmental considerations for CAS 1000512-13-9 include studies on its biodegradation and ecotoxicology. As with many chlorinated pyridines, understanding its environmental fate is crucial for responsible use. Recent advances in green chemistry aim to minimize potential environmental impacts while maintaining the compound's utility in various applications.
In conclusion, 3-(2-chloropyridin-3-yl)propan-1-amine represents an important class of nitrogen-containing heterocycles with wide-ranging applications in modern chemistry. Its unique structural features and reactivity profile continue to make it valuable for researchers across multiple disciplines. As chemical innovation addresses global challenges in health, agriculture, and materials science, compounds like 1000512-13-9 will undoubtedly play significant roles in scientific advancement.
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