Cas no 35493-42-6 (2-butylcyclobutanone)
2-butylcyclobutanone Chemical and Physical Properties
Names and Identifiers
-
- Cyclobutanone, 2-butyl-
- 2-butylcyclobutanone
- 2-butylcyclobutan-1-one
- 2-butyl-cyclobutan-1-one
- SCHEMBL2691796
- 35493-42-6
-
- Inchi: 1S/C8H14O/c1-2-3-4-7-5-6-8(7)9/h7H,2-6H2,1H3
- InChI Key: KYEUSBNBGPTJSX-UHFFFAOYSA-N
- SMILES: O=C1CCC1CCCC
Computed Properties
- Exact Mass: 126.10452
- Monoisotopic Mass: 126.104465066g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 3
- Complexity: 107
- 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
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
2-butylcyclobutanone Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| NAN JING YAO SHI KE JI GU FEN Co., Ltd. | PBHW032-1 G |
2-butylcyclobutanone |
35493-42-6 | 95% | 1g |
¥ 5,610.00 | 2021-05-07 | |
| Chemenu | CM389960-1g |
2-butylcyclobutanone |
35493-42-6 | 95%+ | 1g |
$837 | 2023-01-19 | |
| NAN JING YAO SHI KE JI GU FEN Co., Ltd. | PBHW032-100.0mg |
2-butylcyclobutanone |
35493-42-6 | 95% | 100.0mg |
¥1406.0000 | 2025-04-11 | |
| NAN JING YAO SHI KE JI GU FEN Co., Ltd. | PBHW032-250.0mg |
2-butylcyclobutanone |
35493-42-6 | 95% | 250.0mg |
¥2244.0000 | 2025-04-11 | |
| NAN JING YAO SHI KE JI GU FEN Co., Ltd. | PBHW032-500.0mg |
2-butylcyclobutanone |
35493-42-6 | 95% | 500.0mg |
¥3741.0000 | 2025-04-11 | |
| NAN JING YAO SHI KE JI GU FEN Co., Ltd. | PBHW032-1.0g |
2-butylcyclobutanone |
35493-42-6 | 95% | 1.0g |
¥5610.0000 | 2025-04-11 | |
| NAN JING YAO SHI KE JI GU FEN Co., Ltd. | PBHW032-5.0g |
2-butylcyclobutanone |
35493-42-6 | 95% | 5.0g |
¥16830.0000 | 2025-04-11 | |
| NAN JING YAO SHI KE JI GU FEN Co., Ltd. | PBHW032-100mg |
2-butylcyclobutanone |
35493-42-6 | 95% | 100mg |
¥1406.0 | 2024-04-19 | |
| NAN JING YAO SHI KE JI GU FEN Co., Ltd. | PBHW032-250mg |
2-butylcyclobutanone |
35493-42-6 | 95% | 250mg |
¥2244.0 | 2024-04-19 | |
| NAN JING YAO SHI KE JI GU FEN Co., Ltd. | PBHW032-500mg |
2-butylcyclobutanone |
35493-42-6 | 95% | 500mg |
¥3741.0 | 2024-04-19 |
2-butylcyclobutanone Related Literature
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
-
Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
-
Bruce Parkinson Energy Environ. Sci., 2010,3, 509-511
Additional information on 2-butylcyclobutanone
Cyclobutanone, 2-butyl- and Its Emerging Applications in Chemical Biology
Cyclobutanone, 2-butyl- (CAS No. 35493-42-6) is a heterocyclic compound that has garnered significant attention in the field of chemical biology due to its unique structural properties and versatile reactivity. This compound belongs to the cyclobutanone family, which is characterized by a four-membered ring containing a ketone functional group. The presence of the butyl substituent at the 2-position enhances its chemical versatility, making it a valuable intermediate in synthetic chemistry and a potential candidate for various biological applications.
The molecular structure of Cyclobutanone, 2-butyl- consists of a cyclobutane ring with a carbonyl group at the 2-position and a butyl group attached to the same carbon. This arrangement imparts distinct electronic and steric properties, enabling diverse chemical transformations. The compound’s stability under various reaction conditions makes it an attractive building block for the synthesis of more complex molecules.
In recent years, Cyclobutanone, 2-butyl- has been extensively studied for its potential applications in drug discovery and development. Its ability to act as a precursor for the synthesis of pharmacologically active compounds has made it a focus of interest for medicinal chemists. One of the most compelling aspects of this compound is its role in generating novel scaffolds that can be modified to enhance bioactivity. For instance, derivatives of Cyclobutanone, 2-butyl- have been explored as inhibitors of various enzymes involved in metabolic pathways relevant to diseases such as diabetes and cancer.
Recent research has highlighted the utility of Cyclobutanone, 2-butyl- in the development of small-molecule probes for studying protein-protein interactions. The compound’s ability to undergo selective modifications allows researchers to design probes that can specifically target and label interacting proteins in cellular environments. This approach has been particularly useful in elucidating complex signaling networks and understanding the mechanisms underlying various biological processes.
The synthesis of Cyclobutanone, 2-butyl- can be achieved through several routes, each offering distinct advantages depending on the desired scale and purity requirements. One common method involves the reaction of butyl acetoacetate with an organolithium reagent followed by cyclization under acidic conditions. Alternatively, catalytic hydrogenation of cyclobutenone derivatives can provide access to this compound with high yield and selectivity. These synthetic strategies have been optimized to ensure scalability, making Cyclobutanone, 2-butyl- readily available for industrial applications.
The pharmacological potential of Cyclobutanone, 2-butyl- has been further explored through computational modeling and high-throughput screening techniques. These approaches have identified several derivatives with enhanced binding affinity and selectivity towards target enzymes and receptors. For example, modifications at the butyl substituent have been shown to improve solubility and metabolic stability, critical factors for drug-like properties.
In addition to its applications in drug discovery, Cyclobutanone, 2-butyl- has found utility in materials science. Its unique electronic properties make it a candidate for developing organic semiconductors and liquid crystals. Researchers have investigated its incorporation into polymer matrices to enhance thermal stability and mechanical strength. These findings suggest that Cyclobutanone, 2-butyl- could play a significant role in advancing next-generation materials with tailored properties.
The environmental impact of synthesizing and using Cyclobutanone, 2-butyl- has also been a subject of interest. Efforts have been made to develop greener synthetic routes that minimize waste and reduce energy consumption. For instance, biocatalytic methods using engineered enzymes have been explored as alternatives to traditional chemical synthesis. These approaches align with the growing emphasis on sustainable chemistry practices in industrial applications.
The future prospects for Cyclobutanone, 2-butyl- are promising, with ongoing research focusing on expanding its applications in chemical biology and materials science. Advances in synthetic methodologies will continue to enhance access to this compound and its derivatives, facilitating further exploration of their biological activities. Additionally, interdisciplinary collaborations between chemists, biologists, and material scientists will drive innovation by leveraging the unique properties of Cyclobutanone, 2-butyl-.
35493-42-6 (2-butylcyclobutanone) Related Products
- 3019-25-8(1-cyclobutylethan-1-one)
- 10374-14-8(2-ethylcyclobutanone)
- 35493-46-0(2-Dodecylcyclobutanone)
- 39257-06-2(1-[cis-2-methylcyclobutyl]ethanone)
- 154885-06-0(Ethanone,1-(3-butylcyclobutyl)-, cis- (9CI))
- 154885-08-2(Ethanone, 1-(3-butylcyclobutyl)-, trans- (9CI))
- 35493-47-1(2-Tetradecylcyclobutanone)
- 39257-07-3(1-[trans-2-methylcyclobutyl]ethanone)
- 1517-15-3(2-methylcyclobutan-1-one)
- 226700-93-2([1,1-Bicyclobutyl]-3-carboxaldehyde, 3-oxo- (9CI))