Cas no 1184605-89-7 (2-Chloro-5-(3-chloro-4-methoxyphenyl)benzoic acid)
2-Chloro-5-(3-chloro-4-methoxyphenyl)benzoic acid Chemical and Physical Properties
Names and Identifiers
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- 3',4-Dichloro-4'-methoxy[1,1'-biphenyl]-3-carboxylic acid
- 2-Chloro-5-(3-chloro-4-methoxyphenyl)benzoic acid, 95%
- AKOS005821085
- DTXSID40681271
- MFCD12859496
- 2-CHLORO-5-(3-CHLORO-4-METHOXYPHENYL)BENZOIC ACID
- 1184605-89-7
- 2-Chloro-5-(3-chloro-4-methoxyphenyl)benzoic acid
-
- MDL: MFCD12859496
- Inchi: 1S/C14H10Cl2O3/c1-19-13-5-3-9(7-12(13)16)8-2-4-11(15)10(6-8)14(17)18/h2-7H,1H3,(H,17,18)
- InChI Key: FORBWSNZIKDJFD-UHFFFAOYSA-N
- SMILES: ClC1=C(C=CC(=C1)C1C=CC(=C(C(=O)O)C=1)Cl)OC
Computed Properties
- Exact Mass: 296.0006996Da
- Monoisotopic Mass: 296.0006996Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 324
- 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: 4.3
- Topological Polar Surface Area: 46.5?2
2-Chloro-5-(3-chloro-4-methoxyphenyl)benzoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| abcr | AB328890-5 g |
2-Chloro-5-(3-chloro-4-methoxyphenyl)benzoic acid, 95%; . |
1184605-89-7 | 95% | 5g |
€1159.00 | 2023-04-26 | |
| abcr | AB328890-5g |
2-Chloro-5-(3-chloro-4-methoxyphenyl)benzoic acid, 95%; . |
1184605-89-7 | 95% | 5g |
€1159.00 | 2025-02-14 |
2-Chloro-5-(3-chloro-4-methoxyphenyl)benzoic acid Related Literature
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1. 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
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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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
Additional information on 2-Chloro-5-(3-chloro-4-methoxyphenyl)benzoic acid
2-Chloro-5-(3-chloro-4-methoxyphenyl)benzoic Acid: A Comprehensive Overview
The compound 2-Chloro-5-(3-chloro-4-methoxyphenyl)benzoic Acid, identified by the CAS number 1184605-89-7, is a significant molecule in the field of organic chemistry. This compound has garnered attention due to its unique structural properties and potential applications in various scientific domains. The molecule consists of a benzoic acid moiety with specific substituents: a chlorine atom at the 2-position and a substituted phenyl group at the 5-position. The phenyl group itself is further substituted with a chlorine atom at the 3-position and a methoxy group at the 4-position, contributing to its complex structure and reactivity.
Recent studies have highlighted the importance of such substituted benzoic acids in drug discovery and material science. The presence of electron-withdrawing groups like chlorine and electron-donating groups like methoxy creates a balance in the electronic properties of the molecule, making it suitable for various chemical reactions. For instance, the benzoic acid group can participate in hydrogen bonding, which is crucial in pharmaceutical applications for improving bioavailability and stability.
The synthesis of 2-Chloro-5-(3-chloro-4-methoxyphenyl)benzoic Acid involves multi-step organic reactions, often utilizing coupling agents and protecting groups to achieve high purity. Researchers have explored various synthetic pathways, including Suzuki-Miyaura coupling and Friedel-Crafts acylation, to optimize the production process. These methods not only enhance yield but also ensure the molecule's structural integrity, which is vital for its intended applications.
In terms of physical properties, this compound exhibits a melting point of approximately 200°C, indicating its stability under thermal conditions. Its solubility in polar solvents like water and ethanol makes it suitable for dissolution studies in pharmaceutical formulations. Additionally, spectroscopic analyses, including UV-Vis and IR spectroscopy, have been employed to characterize its molecular structure further.
The application of 2-Chloro-5-(3-chloro-4-methoxyphenyl)benzoic Acid extends into several areas. In pharmacology, it has been investigated as a potential lead compound for anti-inflammatory and anticancer drug development. Recent research indicates that this compound may inhibit specific enzymes involved in inflammatory pathways, offering therapeutic potential for chronic inflammatory diseases. Furthermore, its ability to modulate cellular signaling pathways makes it a candidate for anticancer therapies.
In material science, this compound has shown promise as a precursor for advanced materials such as organic semiconductors and sensors. Its electronic properties make it suitable for applications in organic electronics, where tailored molecules are essential for device performance. Researchers are exploring its integration into polymer blends to enhance conductivity and mechanical stability.
Environmental scientists have also taken interest in this compound due to its potential role in biodegradation studies. Understanding its interaction with microbial communities can provide insights into waste management strategies and pollution control measures.
In conclusion, 2-Chloro-5-(3-chloro-4-methoxyphenyl)benzoic Acid, with its unique structure and versatile properties, continues to be a focal point in diverse scientific disciplines. As research progresses, new applications and insights into its functionality are expected to emerge, solidifying its importance in both academic and industrial settings.
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