Cas no 172921-32-3 (2,5-difluoro-4-nitro-benzonitrile)
2,5-difluoro-4-nitro-benzonitrile Chemical and Physical Properties
Names and Identifiers
-
- 2,5-difluoro-4-nitrobenzonitrile
- Benzonitrile, 2,?5-?difluoro-?4-?nitro-
- HKKHVLVXHJDVQE-UHFFFAOYSA-N
- 2,5-Difluoro-4-nitro-benzonitrile
- AK167203
- SCHEMBL4614436
- AKOS025287143
- s10835
- SY155786
- MFCD13185567
- DS-9243
- XGA92132
- CS-0157899
- DB-226851
- EN300-137683
- 172921-32-3
- 2,5-difluoro-4-nitro-benzonitrile
-
- MDL: MFCD13185567
- Inchi: 1S/C7H2F2N2O2/c8-5-2-7(11(12)13)6(9)1-4(5)3-10/h1-2H
- InChI Key: HKKHVLVXHJDVQE-UHFFFAOYSA-N
- SMILES: FC1C=C(C#N)C(=CC=1[N+](=O)[O-])F
Computed Properties
- Exact Mass: 184.00843363g/mol
- Monoisotopic Mass: 184.00843363g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 257
- 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
- Topological Polar Surface Area: 69.6
- XLogP3: 1.7
Experimental Properties
- Density: 1.51±0.1 g/cm3 (20 oC 760 Torr),
- Solubility: Almost insoluble (0.064 g/l) (25 o C),
2,5-difluoro-4-nitro-benzonitrile Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-LR695-200mg |
2,5-difluoro-4-nitro-benzonitrile |
172921-32-3 | 95+% | 200mg |
259.0CNY | 2021-07-10 | |
| abcr | AB487254-250 mg |
2,5-Difluoro-4-nitrobenzonitrile; . |
172921-32-3 | 250MG |
€128.10 | 2023-04-20 | ||
| abcr | AB487254-1 g |
2,5-Difluoro-4-nitrobenzonitrile; . |
172921-32-3 | 1g |
€220.50 | 2023-04-20 | ||
| abcr | AB487254-5 g |
2,5-Difluoro-4-nitrobenzonitrile; . |
172921-32-3 | 5g |
€540.80 | 2023-04-20 | ||
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-LR695-50mg |
2,5-difluoro-4-nitro-benzonitrile |
172921-32-3 | 95+% | 50mg |
111.0CNY | 2021-07-10 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-LR695-1g |
2,5-difluoro-4-nitro-benzonitrile |
172921-32-3 | 95+% | 1g |
780.0CNY | 2021-07-10 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-LR695-250mg |
2,5-difluoro-4-nitro-benzonitrile |
172921-32-3 | 95+% | 250mg |
742CNY | 2021-05-08 | |
| eNovation Chemicals LLC | Y0991279-5g |
2,5-difluoro-4-nitrobenzonitrile |
172921-32-3 | 95% | 5g |
$310 | 2024-08-02 | |
| Enamine | EN300-137683-0.05g |
2,5-difluoro-4-nitrobenzonitrile |
172921-32-3 | 95% | 0.05g |
$30.0 | 2023-02-15 | |
| Enamine | EN300-137683-0.1g |
2,5-difluoro-4-nitrobenzonitrile |
172921-32-3 | 95% | 0.1g |
$45.0 | 2023-02-15 |
2,5-difluoro-4-nitro-benzonitrile Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
Additional information on 2,5-difluoro-4-nitro-benzonitrile
2,5-Difluoro-4-Nitrobenzonitrile: A Comprehensive Overview
2,5-Difluoro-4-nitrobenzonitrile, also known by its CAS number 172921-32-3, is a highly specialized organic compound with significant applications in various fields of chemistry and material science. This compound is characterized by its unique structure, which includes a benzonitrile core substituted with two fluorine atoms at the 2 and 5 positions and a nitro group at the 4 position. The combination of these substituents imparts distinctive electronic and steric properties to the molecule, making it valuable for advanced chemical synthesis and research.
The synthesis of 2,5-difluoro-4-nitrobenzonitrile typically involves multi-step reactions that require precise control over reaction conditions to achieve high purity and yield. Recent advancements in synthetic methodologies have enabled more efficient routes for the preparation of this compound. For instance, researchers have explored the use of microwave-assisted synthesis to accelerate reaction times while maintaining product quality. Such innovations highlight the ongoing efforts to optimize the production of this compound for industrial and academic purposes.
In terms of chemical properties, 2,5-difluoro-4-nitrobenzonitrile exhibits notable stability under standard laboratory conditions. However, its reactivity can be significantly influenced by the presence of electron-withdrawing groups such as the nitro and cyano functionalities. These groups enhance the electrophilic character of the aromatic ring, making it a suitable substrate for various electrophilic substitution reactions. Recent studies have demonstrated its utility in Suzuki-Miyaura coupling reactions, where it serves as an effective arylating agent due to its high reactivity and compatibility with palladium catalysts.
The application of 2,5-difluoro-4-nitrobenzonitrile extends beyond traditional organic synthesis. It has found significant use in materials science, particularly in the development of advanced polymers and optoelectronic materials. For example, researchers have incorporated this compound into polymeric frameworks to enhance their thermal stability and electronic conductivity. The fluorine substituents contribute to improved resistance to UV degradation, while the nitro group provides additional functionalization opportunities for tailoring material properties.
Recent research has also explored the potential of 2,5-difluoro-4-nitrobenzonitrile in pharmaceutical chemistry. Its unique structure makes it a promising candidate for drug design, particularly in targeting specific biological pathways. Studies have shown that this compound exhibits moderate inhibitory activity against certain enzymes involved in inflammatory processes, suggesting its potential as a lead compound for anti-inflammatory drug development.
In conclusion, 2,5-difluoro-4-nitrobenzonitrile (CAS No. 172921-32-3) is a versatile compound with a wide range of applications across multiple disciplines. Its unique chemical properties and reactivity make it an invaluable tool for researchers in organic synthesis, materials science, and pharmaceutical chemistry. As ongoing studies continue to uncover new uses and optimizations for this compound, its significance in both academic and industrial settings is expected to grow further.
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