Cas no 1178202-04-4 (2-Chloro-5-(4-methoxy-3-methylphenyl)benzoic acid)
2-Chloro-5-(4-methoxy-3-methylphenyl)benzoic acid Chemical and Physical Properties
Names and Identifiers
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- 2-Chloro-5-(4-methoxy-3-methylphenyl)benzoic acid, 95%
- 4-Chloro-4'-methoxy-3'-methyl[1,1'-biphenyl]-3-carboxylic acid
- MFCD12859522
- 1178202-04-4
- AKOS005820760
- 2-CHLORO-5-(4-METHOXY-3-METHYLPHENYL)BENZOIC ACID
- DTXSID50681282
- 2-Chloro-5-(4-methoxy-3-methylphenyl)benzoic acid
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- MDL: MFCD12859522
- Inchi: 1S/C15H13ClO3/c1-9-7-10(4-6-14(9)19-2)11-3-5-13(16)12(8-11)15(17)18/h3-8H,1-2H3,(H,17,18)
- InChI Key: ZSOZNZLSWBSXIK-UHFFFAOYSA-N
- SMILES: ClC1C=CC(=CC=1C(=O)O)C1=CC=C(C(C)=C1)OC
Computed Properties
- Exact Mass: 276.0553220Da
- Monoisotopic Mass: 276.0553220Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 321
- 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
- Topological Polar Surface Area: 46.5?2
2-Chloro-5-(4-methoxy-3-methylphenyl)benzoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| abcr | AB327560-5 g |
2-Chloro-5-(4-methoxy-3-methylphenyl)benzoic acid, 95%; . |
1178202-04-4 | 95% | 5g |
€1159.00 | 2023-04-26 | |
| abcr | AB327560-5g |
2-Chloro-5-(4-methoxy-3-methylphenyl)benzoic acid, 95%; . |
1178202-04-4 | 95% | 5g |
€1159.00 | 2024-06-08 |
2-Chloro-5-(4-methoxy-3-methylphenyl)benzoic acid Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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4. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
Additional information on 2-Chloro-5-(4-methoxy-3-methylphenyl)benzoic acid
Comprehensive Overview of 2-Chloro-5-(4-methoxy-3-methylphenyl)benzoic acid (CAS No. 1178202-04-4)
2-Chloro-5-(4-methoxy-3-methylphenyl)benzoic acid (CAS No. 1178202-04-4) is a specialized organic compound that has garnered significant attention in pharmaceutical and agrochemical research. This benzoic acid derivative is characterized by its unique molecular structure, featuring a chloro substituent and a methoxy-methylphenyl group, which contribute to its potential applications in drug discovery and material science. Researchers are increasingly exploring its role as a key intermediate in synthesizing bioactive molecules, particularly in the development of non-steroidal anti-inflammatory drugs (NSAIDs) and herbicides.
The compound’s CAS No. 1178202-04-4 is frequently searched in academic and industrial databases, reflecting its relevance in medicinal chemistry and crop protection. Recent trends indicate growing interest in its structure-activity relationship (SAR), as scientists aim to optimize its efficacy while minimizing side effects. With the rise of green chemistry initiatives, there is also a focus on developing eco-friendly synthesis routes for this compound, aligning with global sustainability goals.
One of the most discussed topics surrounding 2-Chloro-5-(4-methoxy-3-methylphenyl)benzoic acid is its potential as a building block for APIs (Active Pharmaceutical Ingredients). Its structural versatility allows for modifications that can enhance bioavailability and target specificity, making it a candidate for treating chronic inflammatory conditions. Additionally, its application in agrochemical formulations has been explored, with studies highlighting its role in pest resistance management.
From a technical perspective, the compound’s physicochemical properties, such as solubility, melting point, and stability, are critical for its practical use. Analytical techniques like HPLC, NMR, and mass spectrometry are commonly employed to ensure purity and consistency, especially in GMP-compliant production. These factors are vital for researchers and manufacturers aiming to meet regulatory standards in pharmaceutical and agricultural sectors.
In the context of market demand, CAS No. 1178202-04-4 has seen a steady increase in procurement inquiries, driven by its utility in high-value chemical synthesis. Companies specializing in custom synthesis and contract research often list this compound in their portfolios, catering to clients seeking tailored solutions for complex molecular projects. Its compatibility with automated synthesis platforms further enhances its appeal in modern high-throughput screening environments.
Looking ahead, the future of 2-Chloro-5-(4-methoxy-3-methylphenyl)benzoic acid appears promising, with ongoing studies investigating its mechanistic pathways and derivative potential. As the scientific community continues to prioritize precision medicine and sustainable agriculture, this compound is poised to play a pivotal role in advancing these fields. Its integration into AI-driven drug design platforms further underscores its relevance in the era of digital chemistry.
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