Cas no 917969-77-8 (Pyridine, 2-chloro-3-(chloromethyl)-6-(trifluoromethyl)-)
Pyridine, 2-chloro-3-(chloromethyl)-6-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Pyridine, 2-chloro-3-(chloromethyl)-6-(trifluoromethyl)-
- 2-Chloro-3-(chloromethyl)-6-(trifluoromethyl)pyridine
- 917969-77-8
- DTXSID40733143
- 2-chloro-3-chloromethyl-6-(trifluoromethyl)pyridine
- MFCD16608128
- SCHEMBL4485875
-
- MDL: MFCD16608128
- Inchi: 1S/C7H4Cl2F3N/c8-3-4-1-2-5(7(10,11)12)13-6(4)9/h1-2H,3H2
- InChI Key: WFJHZHHDELZBRW-UHFFFAOYSA-N
- SMILES: ClC1=C(CCl)C=CC(C(F)(F)F)=N1
Computed Properties
- Exact Mass: 228.9672890g/mol
- Monoisotopic Mass: 228.9672890g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 174
- 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: 3.1
- Topological Polar Surface Area: 12.9?2
Pyridine, 2-chloro-3-(chloromethyl)-6-(trifluoromethyl)- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Matrix Scientific | 128345-1g |
2-Chloro-3-(chloromethyl)-6-(trifluoromethyl)pyridine, 97% |
917969-77-8 | 97% | 1g |
$1862.00 | 2023-09-07 | |
| eNovation Chemicals LLC | D684938-500mg |
2-Chloro-3-(chloromethyl)-6-(trifluoromethyl)pyridine |
917969-77-8 | 95% | 500mg |
$750 | 2025-02-19 | |
| eNovation Chemicals LLC | D684938-1g |
2-Chloro-3-(chloromethyl)-6-(trifluoromethyl)pyridine |
917969-77-8 | 95% | 1g |
$980 | 2025-02-19 | |
| eNovation Chemicals LLC | D684938-1g |
2-Chloro-3-(chloromethyl)-6-(trifluoromethyl)pyridine |
917969-77-8 | 95% | 1g |
$980 | 2025-02-25 | |
| eNovation Chemicals LLC | D684938-500mg |
2-Chloro-3-(chloromethyl)-6-(trifluoromethyl)pyridine |
917969-77-8 | 95% | 500mg |
$750 | 2025-02-25 | |
| eNovation Chemicals LLC | D684938-500mg |
2-Chloro-3-(chloromethyl)-6-(trifluoromethyl)pyridine |
917969-77-8 | 95% | 500mg |
$750 | 2024-08-03 | |
| eNovation Chemicals LLC | D684938-1g |
2-Chloro-3-(chloromethyl)-6-(trifluoromethyl)pyridine |
917969-77-8 | 95% | 1g |
$980 | 2024-08-03 |
Pyridine, 2-chloro-3-(chloromethyl)-6-(trifluoromethyl)- Related Literature
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
Additional information on Pyridine, 2-chloro-3-(chloromethyl)-6-(trifluoromethyl)-
Research Briefing on Pyridine, 2-chloro-3-(chloromethyl)-6-(trifluoromethyl)- (CAS: 917969-77-8) in Chemical and Biomedical Applications
Pyridine, 2-chloro-3-(chloromethyl)-6-(trifluoromethyl)- (CAS: 917969-77-8) is a specialized pyridine derivative that has garnered significant attention in recent chemical and biomedical research due to its unique structural properties and potential applications. This compound features a trifluoromethyl group and chloromethyl substituents, which enhance its reactivity and utility in pharmaceutical synthesis and agrochemical development. Recent studies have explored its role as a key intermediate in the synthesis of bioactive molecules, particularly in the development of novel antimicrobial and anticancer agents.
In a 2023 study published in the Journal of Medicinal Chemistry, researchers investigated the compound's efficacy as a building block for heterocyclic compounds with antimicrobial properties. The study demonstrated that derivatives synthesized from 917969-77-8 exhibited potent activity against multidrug-resistant bacterial strains, including MRSA and Pseudomonas aeruginosa. The presence of the trifluoromethyl group was found to significantly enhance membrane permeability, a critical factor in overcoming bacterial resistance mechanisms. These findings highlight the compound's potential in addressing the global challenge of antibiotic resistance.
Another notable application of Pyridine, 2-chloro-3-(chloromethyl)-6-(trifluoromethyl)- was reported in a 2024 ACS Chemical Biology paper, where it served as a precursor for developing small-molecule inhibitors targeting protein-protein interactions (PPIs) in cancer pathways. The chloromethyl moiety allowed for facile functionalization, enabling the creation of a library of compounds with varying binding affinities to oncogenic targets. One derivative, in particular, showed promising inhibition of the MDM2-p53 interaction, a well-validated target in oncology, with an IC50 value of 0.8 μM.
From a synthetic chemistry perspective, advances in the scalable production of 917969-77-8 have been achieved through continuous flow chemistry techniques. A 2023 Organic Process Research & Development article detailed an optimized protocol that improved yield by 35% while reducing hazardous waste generation compared to traditional batch methods. This progress addresses one of the key challenges in utilizing this compound industrially, where safety and environmental concerns have previously limited its adoption.
The compound's unique electronic properties, conferred by the electron-withdrawing trifluoromethyl group and electron-donating pyridine nitrogen, have also made it a subject of interest in materials science. Recent work published in Advanced Materials (2024) demonstrated its incorporation into organic semiconductors for optoelectronic devices. The resulting materials showed exceptional charge transport properties and air stability, suggesting potential applications in flexible electronics and photovoltaic systems.
In conclusion, Pyridine, 2-chloro-3-(chloromethyl)-6-(trifluoromethyl)- (CAS: 917969-77-8) represents a versatile chemical scaffold with demonstrated applications across multiple disciplines. Its ongoing investigation in antimicrobial development, cancer therapeutics, and materials science underscores its importance in contemporary research. Future directions may include further exploration of its structure-activity relationships and the development of greener synthetic routes to meet growing industrial demand.
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