Cas no 1261925-56-7 (2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid)
2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid Chemical and Physical Properties
Names and Identifiers
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- DTXSID40690828
- MFCD18321363
- 2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid, 95%
- 2-CHLORO-4-(2,5-DIMETHOXYPHENYL)BENZOIC ACID
- 1261925-56-7
- 3-Chloro-2',5'-dimethoxy[1,1'-biphenyl]-4-carboxylic acid
- 2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid
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- MDL: MFCD18321363
- Inchi: 1S/C15H13ClO4/c1-19-10-4-6-14(20-2)12(8-10)9-3-5-11(15(17)18)13(16)7-9/h3-8H,1-2H3,(H,17,18)
- InChI Key: PCTCUPWACRTATG-UHFFFAOYSA-N
- SMILES: ClC1=C(C(=O)O)C=CC(=C1)C1C=C(C=CC=1OC)OC
Computed Properties
- Exact Mass: 292.0502366Da
- Monoisotopic Mass: 292.0502366Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 336
- 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: 3.6
- Topological Polar Surface Area: 55.8?2
2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| abcr | AB328584-5g |
2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid, 95%; . |
1261925-56-7 | 95% | 5g |
€1159.00 | 2025-04-21 | |
| abcr | AB328584-5 g |
2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid, 95%; . |
1261925-56-7 | 95% | 5g |
€1159.00 | 2023-04-26 |
2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid Related Literature
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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3. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
Additional information on 2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid
Introduction to 2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid (CAS No. 1261925-56-7)
2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid, identified by its Chemical Abstracts Service (CAS) number 1261925-56-7, is a specialized organic compound that has garnered significant attention in the field of pharmaceutical chemistry and medicinal research. This benzoic acid derivative features a chloro substituent at the 2-position and a dimethoxyphenyl group at the 4-position, which endows it with unique chemical properties and potential biological activities. The structural configuration of this compound makes it a valuable scaffold for the development of novel therapeutic agents.
The synthesis of 2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid involves multi-step organic reactions, typically starting from commercially available aromatic precursors. The introduction of the chloro group at the para position relative to the dimethoxyphenyl moiety enhances its reactivity, allowing for further functionalization. This compound has been studied for its role in various chemical transformations, including condensation reactions, cyclization processes, and as an intermediate in the synthesis of more complex molecules.
In recent years, 2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid has been explored for its pharmacological potential. The dimethoxyphenyl group is known to contribute to the compound's solubility and bioavailability, while the chloro substituent can serve as a handle for further derivatization. Preliminary studies have suggested that this compound may exhibit properties relevant to anti-inflammatory, antioxidant, and antimicrobial applications. These findings are particularly intriguing given the increasing demand for natural product-inspired drug candidates.
The benzoic acid core is a well-documented pharmacophore in medicinal chemistry, with numerous derivatives having been investigated for their therapeutic effects. The structural motif of 2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid aligns with this tradition, offering a promising platform for drug discovery. Researchers have leveraged computational methods to predict the binding affinity of this compound to various biological targets, including enzymes and receptors implicated in metabolic disorders and neurological diseases.
One of the most compelling aspects of 2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid is its versatility as a building block. Its unique substitution pattern allows chemists to introduce additional functional groups or modify existing ones, enabling the creation of libraries of analogs with tailored properties. This flexibility has been exploited in high-throughput screening campaigns aimed at identifying lead compounds for further development.
The pharmaceutical industry has shown particular interest in compounds that can modulate inflammatory pathways. Benzoic acid derivatives are known to interact with key mediators of inflammation, such as cyclooxygenase (COX) and lipoxygenase enzymes. Given the structural features of 2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid, it is hypothesized that this compound could interfere with these pathways by serving as a competitive inhibitor or by influencing enzyme activity indirectly.
Another area of investigation has focused on the potential antimicrobial properties of this compound. The presence of both electron-withdrawing (chloro) and electron-donating (dimethoxy) groups creates a delicate balance that may enhance interactions with bacterial cell membranes or essential metabolic enzymes. Early experiments have demonstrated activity against certain Gram-positive bacteria, suggesting that further optimization could yield potent antimicrobial agents.
The role of 2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid in material science is also emerging as an important field of study. Its ability to participate in coordination chemistry has led to investigations into its use as a ligand or precursor for metal-organic frameworks (MOFs). These materials have applications in gas storage, catalysis, and sensing technologies, making this compound a candidate for interdisciplinary research.
In conclusion,2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid (CAS No. 1261925-56-7) represents a fascinating compound with diverse applications across multiple scientific domains. Its unique structural features have positioned it as a key intermediate in pharmaceutical synthesis and as a candidate for developing new therapeutics. As research continues to uncover its full potential,2-Chloro-4-(2,5-dimethoxyphenyl)benzoic acid is likely to remain at the forefront of chemical innovation.
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