Cas no 590371-81-6 (2-Chloro-4-(trifluoromethyl)nicotinic acid)
2-Chloro-4-(trifluoromethyl)nicotinic acid Chemical and Physical Properties
Names and Identifiers
-
- 2-Chloro-4-(trifluoromethyl)nicotinic acid
- 2-Chloro-4-(trifluoromethyl)pyridine-3-carboxylic acid
- 3-Pyridinecarboxylic acid, 2-chloro-4-(trifluoromethyl)-
- CS-W013040
- 590371-81-6
- GD-0745
- MFCD08458125
- AB45625
- 2-chloro-4-(trifluoromethyl)nicotinicacid
- A8319
- J-508706
- SCHEMBL3540937
- DTXSID20472205
- Z1269222248
- FT-0678098
- 2-Chloro-4-(trifluoromethyl)pyridine-3-carboxylic acid, 97%
- C80047
- EN300-96834
- AKOS005072934
- SY014837
- AMY31478
- BBL100417
- STL554211
- DB-024441
-
- MDL： MFCD08458125
- Inchi： 1S/C7H3ClF3NO2/c8-5-4(6(13)14)3(1-2-12-5)7(9,10)11/h1-2H,(H,13,14)
- InChI Key： FZIJHEOXLKCIRZ-UHFFFAOYSA-N
- SMILES： ClC1C(C(=O)O)=C(C=CN=1)C(F)(F)F
Computed Properties
- Exact Mass: 224.98000
- Monoisotopic Mass: 224.9804405g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 234
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 2.2
- Topological Polar Surface Area: 50.2?2
Experimental Properties
- Color/Form: White powder
- Density: 1.604
- Melting Point: 157-160?°C
- Boiling Point: 299.501°C at 760 mmHg
- Flash Point: 134.934°C
- Refractive Index: 1.497
- PSA: 50.19000
- LogP: 2.45200
- Solubility: Not determined
2-Chloro-4-(trifluoromethyl)nicotinic acid Security Information
-
Symbol:
- Signal Word：Warning
- Hazard Statement： H302-H312-H315-H319-H335
- Warning Statement： P261-P280-P305 + P351 + P338
- Hazardous Material transportation number：NONH for all modes of transport
- WGK Germany：3
- Hazard Category Code： 21/22-36/37/38
- Safety Instruction： S26-S36/37
-
Hazardous Material Identification：
- HazardClass：IRRITANT
- Risk Phrases：R21/22; R36/37/38
2-Chloro-4-(trifluoromethyl)nicotinic acid Customs Data
- HS CODE：2933399090
- Customs Data：
China Customs Code:
2933399090Overview:
2933399090. Other compounds with non fused pyridine rings in structure. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date
Summary:
2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
2-Chloro-4-(trifluoromethyl)nicotinic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Matrix Scientific | 023754-500mg |
2-Chloro-4-(trifluoromethyl)nicotinic acid, 97% |
590371-81-6 | 97% | 500mg |
$88.00 | 2023-09-09 | |
| Matrix Scientific | 023754-1g |
2-Chloro-4-(trifluoromethyl)nicotinic acid, 97% |
590371-81-6 | 97% | 1g |
$135.00 | 2023-09-09 | |
| XI GE MA AO DE LI QI （ SHANG HAI ） MAO YI Co., Ltd. | 700622-500MG |
2-Chloro-4-(trifluoromethyl)nicotinic acid |
590371-81-6 | 97% | 500MG |
￥1170.22 | 2022-02-24 | |
| Chemenu | CM178146-5g |
2-Chloro-4-(trifluoromethyl)nicotinic acid |
590371-81-6 | 95% | 5g |
$333 | 2021-08-05 | |
| Chemenu | CM178146-10g |
2-Chloro-4-(trifluoromethyl)nicotinic acid |
590371-81-6 | 95% | 10g |
$557 | 2021-08-05 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R020901-1g |
2-Chloro-4-(trifluoromethyl)nicotinic acid |
590371-81-6 | 98% | 1g |
￥304 | 2024-05-22 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R020901-250mg |
2-Chloro-4-(trifluoromethyl)nicotinic acid |
590371-81-6 | 98% | 250mg |
￥608 | 2024-05-22 | |
| TRC | C381555-50mg |
2-Chloro-4-(trifluoromethyl)nicotinic Acid |
590371-81-6 | 50mg |
$ 50.00 | 2022-06-06 | ||
| TRC | C381555-100mg |
2-Chloro-4-(trifluoromethyl)nicotinic Acid |
590371-81-6 | 100mg |
$ 65.00 | 2022-06-06 | ||
| TRC | C381555-500mg |
2-Chloro-4-(trifluoromethyl)nicotinic Acid |
590371-81-6 | 500mg |
$ 135.00 | 2022-06-06 |
2-Chloro-4-(trifluoromethyl)nicotinic acid Related Literature
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
-
Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
-
Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
Additional information on 2-Chloro-4-(trifluoromethyl)nicotinic acid
Recent Advances in the Study of 2-Chloro-4-(trifluoromethyl)nicotinic acid (CAS: 590371-81-6)
2-Chloro-4-(trifluoromethyl)nicotinic acid (CAS: 590371-81-6) is a key intermediate in the synthesis of various biologically active compounds, particularly in the pharmaceutical and agrochemical industries. Recent studies have highlighted its significance in the development of novel therapeutic agents and its role in chemical synthesis. This research brief aims to summarize the latest findings related to this compound, focusing on its applications, synthesis methods, and biological activities.
One of the most notable advancements in the study of 2-Chloro-4-(trifluoromethyl)nicotinic acid is its application in the synthesis of trifluoromethyl-substituted pyridine derivatives. These derivatives are increasingly recognized for their potential in drug discovery due to their enhanced metabolic stability and bioavailability. A 2023 study published in the Journal of Medicinal Chemistry demonstrated the compound's utility in the synthesis of potent kinase inhibitors, which show promise in treating various cancers.
In addition to its pharmaceutical applications, recent research has explored the agrochemical potential of 2-Chloro-4-(trifluoromethyl)nicotinic acid. A study conducted by researchers at the University of California, Davis, revealed that derivatives of this compound exhibit significant herbicidal activity. The study, published in Pest Management Science, identified several novel herbicidal agents derived from 2-Chloro-4-(trifluoromethyl)nicotinic acid, which could lead to the development of more effective and environmentally friendly herbicides.
The synthesis of 2-Chloro-4-(trifluoromethyl)nicotinic acid has also seen significant improvements. A recent paper in Organic Process Research & Development described a novel, cost-effective method for its production, utilizing a one-pot reaction with improved yield and purity. This advancement is expected to facilitate large-scale production and reduce costs, making the compound more accessible for research and industrial applications.
In conclusion, 2-Chloro-4-(trifluoromethyl)nicotinic acid (CAS: 590371-81-6) continues to be a compound of significant interest in both pharmaceutical and agrochemical research. Its versatile applications, coupled with recent advancements in synthesis methods, underscore its importance in the development of new therapeutic and agrochemical agents. Future research is likely to focus on further optimizing its synthesis and exploring additional biological activities.
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