Cas no 90477-04-6 (1-(azepan-1-yl)-2-chlorobutan-1-one)
1-(azepan-1-yl)-2-chlorobutan-1-one Chemical and Physical Properties
Names and Identifiers
-
- 1H-AZEPINE, 1-(2-CHLORO-1-OXOBUTYL)HEXAHYDRO-
- starbld0035046
- F1908-1692
- 1-(azepan-1-yl)-2-chlorobutan-1-one
- AKOS011508398
- SCHEMBL11061954
- 90477-04-6
-
- Inchi: 1S/C10H18ClNO/c1-2-9(11)10(13)12-7-5-3-4-6-8-12/h9H,2-8H2,1H3
- InChI Key: AOUNXYIWZIHXGJ-UHFFFAOYSA-N
- SMILES: ClC(CC)C(N1CCCCCC1)=O
Computed Properties
- Exact Mass: 203.1076919g/mol
- Monoisotopic Mass: 203.1076919g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 164
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.5
- Topological Polar Surface Area: 20.3?2
1-(azepan-1-yl)-2-chlorobutan-1-one Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | A134226-100mg |
1-(azepan-1-yl)-2-chlorobutan-1-one |
90477-04-6 | 100mg |
$ 135.00 | 2022-06-08 | ||
| TRC | A134226-500mg |
1-(azepan-1-yl)-2-chlorobutan-1-one |
90477-04-6 | 500mg |
$ 525.00 | 2022-06-08 | ||
| TRC | A134226-1g |
1-(azepan-1-yl)-2-chlorobutan-1-one |
90477-04-6 | 1g |
$ 815.00 | 2022-06-08 | ||
| Life Chemicals | F1908-1692-0.25g |
1-(azepan-1-yl)-2-chlorobutan-1-one |
90477-04-6 | 95%+ | 0.25g |
$551.0 | 2023-09-07 | |
| Life Chemicals | F1908-1692-0.5g |
1-(azepan-1-yl)-2-chlorobutan-1-one |
90477-04-6 | 95%+ | 0.5g |
$580.0 | 2023-09-07 | |
| Life Chemicals | F1908-1692-1g |
1-(azepan-1-yl)-2-chlorobutan-1-one |
90477-04-6 | 95%+ | 1g |
$611.0 | 2023-09-07 | |
| Life Chemicals | F1908-1692-2.5g |
1-(azepan-1-yl)-2-chlorobutan-1-one |
90477-04-6 | 95%+ | 2.5g |
$1222.0 | 2023-09-07 | |
| Life Chemicals | F1908-1692-5g |
1-(azepan-1-yl)-2-chlorobutan-1-one |
90477-04-6 | 95%+ | 5g |
$1833.0 | 2023-09-07 | |
| Life Chemicals | F1908-1692-10g |
1-(azepan-1-yl)-2-chlorobutan-1-one |
90477-04-6 | 95%+ | 10g |
$2566.0 | 2023-09-07 |
1-(azepan-1-yl)-2-chlorobutan-1-one Related Literature
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
-
Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
Additional information on 1-(azepan-1-yl)-2-chlorobutan-1-one
Comprehensive Guide to 1H-AZEPINE, 1-(2-CHLORO-1-OXOBUTYL)HEXAHYDRO- (CAS No. 90477-04-6): Properties, Applications, and Market Insights
The chemical compound 1H-AZEPINE, 1-(2-CHLORO-1-OXOBUTYL)HEXAHYDRO- (CAS No. 90477-04-6) is a specialized organic molecule with a unique structure that has garnered attention in various research and industrial applications. This comprehensive guide delves into its chemical properties, synthesis methods, applications, and emerging trends in the market. With the increasing demand for novel organic compounds in pharmaceuticals, agrochemicals, and material science, understanding 1H-AZEPINE derivatives is more relevant than ever.
1H-AZEPINE, 1-(2-CHLORO-1-OXOBUTYL)HEXAHYDRO- belongs to the class of azepine derivatives, which are heterocyclic compounds containing a seven-membered ring with one nitrogen atom. The presence of the 2-chloro-1-oxobutyl substituent adds to its reactivity and potential utility in synthetic chemistry. Researchers often explore such compounds for their ability to act as intermediates in the synthesis of more complex molecules, particularly in drug discovery and material science.
One of the key reasons for the growing interest in 1H-AZEPINE, 1-(2-CHLORO-1-OXOBUTYL)HEXAHYDRO- is its potential role in pharmaceutical research. The azepine ring is a common scaffold in medicinal chemistry, known for its bioactivity and versatility. Recent studies have highlighted its relevance in developing new therapeutic agents, especially in areas like central nervous system (CNS) disorders and anti-inflammatory drugs. This aligns with the current trend of targeting niche therapeutic areas with high unmet medical needs.
In addition to pharmaceuticals, 1H-AZEPINE, 1-(2-CHLORO-1-OXOBUTYL)HEXAHYDRO- has applications in agrochemicals. The compound's structural features make it a candidate for developing novel pesticides or herbicides. With the global push toward sustainable agriculture, researchers are increasingly focusing on eco-friendly agrochemicals, and this compound could play a role in that evolution. Its chloro and carbonyl functional groups offer reactive sites for further modifications, enabling the creation of derivatives with tailored properties.
The synthesis of 1H-AZEPINE, 1-(2-CHLORO-1-OXOBUTYL)HEXAHYDRO- typically involves multi-step organic reactions, including cyclization and acylations. Advanced techniques like microwave-assisted synthesis and catalyzed reactions have been explored to improve yield and efficiency. These methods are particularly relevant in today's context, where green chemistry and process optimization are major focus areas for reducing environmental impact and operational costs.
From a market perspective, the demand for 1H-AZEPINE derivatives is expected to grow, driven by their applications in high-value industries. Companies specializing in fine chemicals and custom synthesis are actively investing in this space to cater to the needs of pharmaceutical and agrochemical clients. Additionally, the rise of AI-driven drug discovery has accelerated the identification of novel azepine-based compounds, further fueling market interest.
For researchers and industry professionals, sourcing high-quality 1H-AZEPINE, 1-(2-CHLORO-1-OXOBUTYL)HEXAHYDRO- is critical. Reputable suppliers often provide detailed analytical data, including NMR spectra and HPLC purity reports, to ensure compliance with research and industrial standards. As the compound gains traction, ensuring supply chain transparency and regulatory compliance will be essential for its sustainable use.
In conclusion, 1H-AZEPINE, 1-(2-CHLORO-1-OXOBUTYL)HEXAHYDRO- (CAS No. 90477-04-6) represents a fascinating area of study with broad applications across multiple industries. Its unique chemical structure, combined with the growing emphasis on sustainable chemistry and innovative drug development, positions it as a compound of significant interest. Whether you are a chemist, a pharmaceutical researcher, or an industry stakeholder, staying updated on the latest developments related to this molecule is crucial for leveraging its full potential.
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