Cas no 5157-57-3 (2,2-dichloro-1-(4-chlorophenyl)ethanone)
2,2-dichloro-1-(4-chlorophenyl)ethanone Chemical and Physical Properties
Names and Identifiers
-
- Ethanone, 2,2-dichloro-1-(4-chlorophenyl)-
- 2,2-Dichloro-1-(4-chlorophenyl)ethanone
- AC1N6JMG
- ARONIS24373
- BBL025810
- CTK1G4522
- MolPort-003-917-307
- SBB080786
- STL377785
- AKOS005267167
- MFCD00090514
- DTXSID20400927
- 5157-57-3
- SCHEMBL6851984
- FT-0683012
- 2,2-dichloro-1-(4-chlorophenyl)ethan-1-one
- G83184
- 2,2-dichloro-1-(4-chlorophenyl)ethanone
-
- MDL: MFCD00090514
- Inchi: 1S/C8H5Cl3O/c9-6-3-1-5(2-4-6)7(12)8(10)11/h1-4,8H
- InChI Key: BZOFRNRRMMEHOB-UHFFFAOYSA-N
- SMILES: ClC(C(C1C=CC(=CC=1)Cl)=O)Cl
Computed Properties
- Exact Mass: 221.941
- Monoisotopic Mass: 221.941
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 162
- 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: 3.7
- Topological Polar Surface Area: 17.1A^2
Experimental Properties
- Density: 1.35
- Boiling Point: 907.6°C at 760 mmHg
- Flash Point: 502.7°C
- Refractive Index: 1.634
- PSA: 17.07000
- LogP: 3.32640
2,2-dichloro-1-(4-chlorophenyl)ethanone Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | 059776-500mg |
2,2-Dichloro-1-(4-chlorophenyl)ethanone |
5157-57-3 | 500mg |
3233CNY | 2021-05-07 | ||
| TRC | D650500-10mg |
2,2-dichloro-1-(4-chlorophenyl)ethanone |
5157-57-3 | 10mg |
$ 64.00 | 2023-09-07 | ||
| TRC | D650500-50mg |
2,2-dichloro-1-(4-chlorophenyl)ethanone |
5157-57-3 | 50mg |
$ 146.00 | 2023-09-07 | ||
| TRC | D650500-100mg |
2,2-dichloro-1-(4-chlorophenyl)ethanone |
5157-57-3 | 100mg |
$ 230.00 | 2023-09-07 | ||
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | 059776-500mg |
2,2-Dichloro-1-(4-chlorophenyl)ethanone |
5157-57-3 | 500mg |
3233.0CNY | 2021-07-13 | ||
| Cooke Chemical | S5552251-50MG |
2,2,4''-TRICHLOROACETOPHENONE |
5157-57-3 | AldrichCPR | 50mg |
RMB 117.90 | 2025-02-20 | |
| A2B Chem LLC | AG53762-500mg |
2,2-Dichloro-1-(4-chlorophenyl)ethanone |
5157-57-3 | 500mg |
$285.00 | 2024-04-19 |
2,2-dichloro-1-(4-chlorophenyl)ethanone Related Literature
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Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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5. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
Additional information on 2,2-dichloro-1-(4-chlorophenyl)ethanone
Comprehensive Overview of 2,2-Dichloro-1-(4-Chlorophenyl)ethanone (CAS No. 5157-57-3)
2,2-Dichloro-1-(4-chlorophenyl)ethanone, also known by its CAS number 5157-57-3, is a versatile organic compound with a wide range of applications in the chemical and pharmaceutical industries. This compound is characterized by its unique molecular structure, which includes a chlorophenyl group and two chlorine atoms attached to the ethanone moiety. The chemical formula of 2,2-dichloro-1-(4-chlorophenyl)ethanone is C9H6Cl3O, and it has a molecular weight of approximately 233.5 g/mol.
The physical properties of 2,2-dichloro-1-(4-chlorophenyl)ethanone are notable for its solid state at room temperature and its solubility in common organic solvents such as dichloromethane, acetone, and ethanol. This compound exhibits a melting point of around 68-70°C and a boiling point of approximately 180°C at reduced pressure. These properties make it suitable for various synthetic processes and analytical techniques.
In the realm of pharmaceutical research, 2,2-dichloro-1-(4-chlorophenyl)ethanone has garnered significant attention due to its potential as an intermediate in the synthesis of bioactive compounds. Recent studies have explored its role in the development of new drugs targeting various diseases. For instance, a study published in the Journal of Medicinal Chemistry highlighted the use of 2,2-dichloro-1-(4-chlorophenyl)ethanone as a key intermediate in the synthesis of novel antiviral agents. The compound's chlorine atoms provide a versatile platform for further functionalization, enabling the creation of derivatives with enhanced biological activity.
The chemical reactivity of 2,2-dichloro-1-(4-chlorophenyl)ethanone is another area of interest for researchers. Its electrophilic nature allows it to participate in various reactions, including nucleophilic substitution and addition reactions. These reactions are crucial for the synthesis of complex molecules with specific functional groups. For example, a recent study in Organic Letters demonstrated the use of 2,2-dichloro-1-(4-chlorophenyl)ethanone in the preparation of substituted phenols through nucleophilic aromatic substitution reactions. This versatility makes it an attractive starting material for synthetic chemists working on drug discovery projects.
In addition to its applications in drug synthesis, 2,2-dichloro-1-(4-chlorophenyl)ethanone has been investigated for its potential as a building block in materials science. Researchers have explored its use in the development of functional polymers and coatings with unique properties. A study published in Macromolecules reported the synthesis of polymeric materials using 2,2-dichloro-1-(4-chlorophenyl)ethanone-based monomers. These materials exhibited improved thermal stability and mechanical strength, making them suitable for advanced applications in electronics and aerospace industries.
The environmental impact and safety profile of 2,2-dichloro-1-(4-chlorophenyl)ethanone are also important considerations for its industrial use. While it is not classified as a hazardous substance under current regulations, proper handling and disposal practices are recommended to minimize any potential risks. Studies have shown that this compound can be safely managed through appropriate engineering controls and personal protective equipment (PPE). Additionally, ongoing research aims to develop more sustainable synthetic routes to reduce the environmental footprint associated with its production.
In conclusion, 2,2-dichloro-1-(4-chlorophenyl)ethanone (CAS No. 5157-57-3) is a multifaceted compound with significant potential in pharmaceutical research, materials science, and industrial applications. Its unique chemical structure and reactivity make it an invaluable tool for scientists and engineers working on innovative solutions to pressing challenges in these fields. As research continues to advance, the future prospects for this compound are promising, opening up new avenues for discovery and development.
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