Cas no 5980-26-7 (2,5-Dichlorobenzamide)
2,5-Dichlorobenzamide Chemical and Physical Properties
Names and Identifiers
-
- 2,5-Dichlorobenzamide
- 2,3-Dichlorobenzamide
- Benzamide, 2,5-dichloro-
- 2,5-Dichloro-benzamide
- Benzamide,2,5-dichloro-
- KSC610K1T
- NMHJIYQWKWHDSX-UHFFFAOYSA-N
- EBD79354
- VZ22201
- AS02859
- ZB008803
- ST2403704
- ST50407490
- F4ZCW2E9FU
- SCHEMBL1086528
- ML750445
- MFCD00017609
- UNII-F4ZCW2E9FU
- NS00034241
- FT-0610300
- 5980-26-7
- SY041304
- IXAZOMIB METABOLITE M4 OR M20
- AKOS008937418
- CS-W015918
- AMY14505
- DTXSID7073985
- D82410
- DS-18490
- DB-053468
- DTXCID8042715
-
- MDL: MFCD00173938
- Inchi: 1S/C7H5Cl2NO/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,(H2,10,11)
- InChI Key: NMHJIYQWKWHDSX-UHFFFAOYSA-N
- SMILES: ClC1C=CC(=CC=1C(N)=O)Cl
Computed Properties
- Exact Mass: 188.97500
- Monoisotopic Mass: 188.975
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 163
- 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: 2
- XLogP3: 2.2
- Topological Polar Surface Area: 43.1
Experimental Properties
- Color/Form: Not determined
- Density: 1.439
- Melting Point: 170-172°C
- Boiling Point: 262.8°C at 760 mmHg
- Flash Point: 112.7 °C
- Refractive Index: 1.596
- PSA: 43.09000
- LogP: 2.79260
- Solubility: Not determined
2,5-Dichlorobenzamide Security Information
- Signal Word:Warning
- Hazard Statement: H315-H319-H335
- Warning Statement: P261-P305+P351+P338
- Safety Instruction: S24/25
-
Hazardous Material Identification:
- Safety Term:S24/25
- Risk Phrases:R36/37/38
- Storage Condition:Sealed in dry,Room Temperature
2,5-Dichlorobenzamide Customs Data
- HS CODE:2924299090
- Customs Data:
China Customs Code:
2924299090Overview:
2924299090. Other cyclic amides(Including cyclic carbamates)(Including their derivatives as well as their salts). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%
Declaration elements:
Product Name, component content, use to, packing
Summary:
2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%
2,5-Dichlorobenzamide Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-SC600-250mg |
2,5-Dichlorobenzamide |
5980-26-7 | 97% | 250mg |
40CNY | 2021-05-08 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-SC600-1g |
2,5-Dichlorobenzamide |
5980-26-7 | 97% | 1g |
¥146.0 | 2022-07-29 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-SC600-5g |
2,5-Dichlorobenzamide |
5980-26-7 | 97% | 5g |
¥525.0 | 2022-07-29 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | D136416-1g |
2,5-Dichlorobenzamide |
5980-26-7 | 97% | 1g |
¥99.90 | 2023-09-03 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | D136416-25g |
2,5-Dichlorobenzamide |
5980-26-7 | 97% | 25g |
¥1188.90 | 2023-09-03 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | D136416-5g |
2,5-Dichlorobenzamide |
5980-26-7 | 97% | 5g |
¥297.90 | 2023-09-03 | |
| Chemenu | CM184947-25g |
2,5-Dichlorobenzamide |
5980-26-7 | 95+% | 25g |
$102 | 2021-06-16 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R022275-25g |
2,5-Dichlorobenzamide |
5980-26-7 | 97% | 25g |
¥1427 | 2024-05-22 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R022275-5g |
2,5-Dichlorobenzamide |
5980-26-7 | 97% | 5g |
¥357 | 2024-05-22 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R022275-1g |
2,5-Dichlorobenzamide |
5980-26-7 | 97% | 1g |
¥120 | 2024-05-22 |
2,5-Dichlorobenzamide Suppliers
2,5-Dichlorobenzamide Related Literature
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Meng Lei,Huayun Feng,Enhe Bai,Hui Zhou,Jia Wang,Yanru Qin,Haoyang Zhang,Xueyuan Wang,Zhaogang Liu,Ou Hai,Jia Liu,Yongqiang Zhu Org. Biomol. Chem. 2019 17 683
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Bei-Bei Zhan,Yan-Hua Liu,Fang Hu,Bing-Feng Shi Chem. Commun. 2016 52 4934
Additional information on 2,5-Dichlorobenzamide
Introduction to 2,5-Dichlorobenzamide (CAS No. 5980-26-7)
2,5-Dichlorobenzamide, with the chemical formula C?H?Cl?NO, is a significant compound in the field of pharmaceutical and agrochemical research. Its molecular structure, featuring two chlorine substituents at the 2- and 5-positions of a benzene ring coupled with an amide functional group, imparts unique reactivity and potential applications. This introduction delves into the compound's properties, synthesis methods, and particularly its emerging role in contemporary scientific investigations.
The CAS number 5980-26-7 provides a unique identifier for this substance, ensuring consistency in documentation and communication within the scientific community. As a chlorinated benzamide derivative, 2,5-Dichlorobenzamide represents a class of molecules that have garnered attention due to their diverse chemical behavior and biological interactions. The presence of chlorine atoms enhances electrophilicity at certain positions on the aromatic ring, making it a versatile intermediate in organic synthesis.
In recent years, 2,5-Dichlorobenzamide has been explored for its potential in medicinal chemistry. Researchers have been particularly interested in its ability to serve as a scaffold for designing novel bioactive molecules. The amide group can participate in hydrogen bonding interactions, which is crucial for drug-receptor binding affinity. Furthermore, the chlorinated aromatic system offers opportunities for modulating electronic properties and metabolic stability.
One of the most compelling areas of research involving 2,5-Dichlorobenzamide is its application in the development of enzyme inhibitors. Studies have demonstrated that derivatives of this compound can interact with specific enzymatic targets, potentially leading to therapeutic applications. For instance, modifications to the benzamide core have been investigated for their effects on protease inhibition, which is relevant in treating inflammatory diseases and infections. The chlorine atoms can be strategically positioned to optimize binding affinity and selectivity.
Another exciting aspect of 2,5-Dichlorobenzamide is its role in materials science. The compound's ability to form stable complexes with metal ions has led to investigations into its use as a ligand in catalytic systems. These metal-organic complexes exhibit unique catalytic properties that could be leveraged in industrial processes or for developing advanced materials with tailored functionalities.
The synthesis of 2,5-Dichlorobenzamide typically involves chlorination of an appropriate benzene precursor followed by amidation. Advanced synthetic methodologies have been developed to improve yield and purity, ensuring that researchers have access to high-quality starting materials for their investigations. Techniques such as palladium-catalyzed cross-coupling reactions and flow chemistry have enhanced the efficiency of producing this compound on both laboratory and industrial scales.
Recent advancements in computational chemistry have also contributed to the understanding of 2,5-Dichlorobenzamide's reactivity and potential applications. Molecular modeling studies predict new derivatives with enhanced biological activity, guiding experimental efforts toward more effective drug candidates. These computational approaches are increasingly integral to modern drug discovery pipelines.
The agrochemical sector has not been left behind in exploring the potential of 2,5-Dichlorobenzamide. Its structural features make it a promising candidate for developing novel pesticides with improved efficacy and environmental safety profiles. Research is ongoing to identify derivatives that can target specific pests while minimizing ecological impact.
In conclusion,2,5-Dichlorobenzamide (CAS No. 5980-26-7) is a multifaceted compound with significant potential across pharmaceuticals, materials science, and agriculture. Its unique structure enables diverse applications, from enzyme inhibition to catalysis and pesticide development. As scientific understanding progresses,2,5-Dichlorobenzamide continues to be a valuable building block for innovation in chemical research.
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