Cas no 1258633-19-0 (3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid)
3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid Chemical and Physical Properties
Names and Identifiers
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- MFCD18086698
- 3-(3-BENZYLOXYPHENYL)-5-HYDROXYBENZOIC ACID
- 3'-(Benzyloxy)-5-hydroxy[1,1'-biphenyl]-3-carboxylic acid
- 1258633-19-0
- 3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid, 95%
- DTXSID10692218
- 3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid
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- MDL: MFCD18086698
- Inchi: 1S/C20H16O4/c21-18-10-16(9-17(11-18)20(22)23)15-7-4-8-19(12-15)24-13-14-5-2-1-3-6-14/h1-12,21H,13H2,(H,22,23)
- InChI Key: GYJSIOPOWDXAGL-UHFFFAOYSA-N
- SMILES: O(CC1C=CC=CC=1)C1=CC=CC(=C1)C1C=C(C=C(C(=O)O)C=1)O
Computed Properties
- Exact Mass: 320.10485899Da
- Monoisotopic Mass: 320.10485899Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 24
- Rotatable Bond Count: 5
- Complexity: 404
- 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: 4.2
- Topological Polar Surface Area: 66.8?2
3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| abcr | AB330143-5 g |
3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid, 95%; . |
1258633-19-0 | 95% | 5g |
€1159.00 | 2023-04-26 | |
| abcr | AB330143-5g |
3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid, 95%; . |
1258633-19-0 | 95% | 5g |
€1159.00 | 2025-02-21 |
3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid Related Literature
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
Additional information on 3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid
Introduction to 3-(3-Benzyloxyphenyl)-5-hydroxybenzoic Acid (CAS No. 1258633-19-0)
3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid, identified by its Chemical Abstracts Service (CAS) number 1258633-19-0, is a specialized organic compound that has garnered significant attention in the field of pharmaceutical chemistry and biochemistry. This compound belongs to the class of benzoic acid derivatives, which are widely recognized for their diverse biological activities and potential therapeutic applications. The structural features of 3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid, particularly the presence of both hydroxyl and benzyloxy functional groups, contribute to its unique chemical properties and make it a valuable scaffold for drug discovery and molecular research.
The synthesis and characterization of 3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid have been extensively studied due to its utility in various chemical transformations. The benzyloxy group at the 3-position enhances the solubility and stability of the molecule, making it suitable for further functionalization. In contrast, the hydroxyl group at the 5-position provides a site for hydrogen bonding interactions, which are crucial for its binding affinity to biological targets. These structural attributes have positioned 3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid as a promising candidate for developing novel pharmacological agents.
Recent advancements in computational chemistry and molecular modeling have further highlighted the potential of 3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid in drug design. Studies have demonstrated that this compound can interact with various enzymes and receptors, suggesting its role in modulating biological pathways. For instance, research indicates that derivatives of benzoic acid exhibit anti-inflammatory, antioxidant, and antimicrobial properties. The specific arrangement of functional groups in 3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid may contribute to these effects by influencing enzyme kinetics and receptor binding affinity.
In the realm of medicinal chemistry, 3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid has been explored as a precursor for more complex molecules. Its structural framework allows for easy modification at multiple sites, enabling chemists to tailor its properties for specific applications. For example, researchers have investigated its use in synthesizing protease inhibitors, which are critical in treating diseases such as cancer and HIV/AIDS. The benzyloxy group can be selectively removed or replaced with other functionalities, thereby expanding the chemical diversity of the resulting compounds.
The pharmacological potential of 3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid has also been examined in preclinical studies. These investigations have revealed that this compound exhibits moderate activity against certain disease models, although further optimization is required to enhance its efficacy and safety profiles. The hydroxyl group has been identified as a key interaction point with biological targets, suggesting that modifications at this position could improve drug-like properties such as bioavailability and metabolic stability.
From a synthetic chemistry perspective, 3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid serves as an important intermediate in multi-step reactions. Its versatility allows chemists to explore different synthetic pathways, including cross-coupling reactions, oxidation processes, and esterification techniques. These methods are essential for constructing more complex molecules with tailored functionalities. The availability of high-quality starting materials like 1258633-19-0 ensures that researchers can pursue innovative synthetic strategies without compromising on purity or yield.
The role of 3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid in academic research continues to evolve as new methodologies emerge. Advances in green chemistry have prompted investigations into sustainable synthetic routes for this compound, emphasizing minimal waste generation and energy efficiency. Additionally, collaborations between academia and industry have led to novel applications of benzoic acid derivatives in areas such as agrochemicals and material science.
In conclusion, 3-(3-Benzyloxyphenyl)-5-hydroxybenzoic acid (CAS No. 1258633-19-0) represents a significant compound in pharmaceutical research due to its structural complexity and functional diversity. Its potential applications span across multiple therapeutic areas, making it a valuable asset for both academic institutions and industrial laboratories. As research progresses, further insights into its biological activities and synthetic utility will continue to drive innovation in drug discovery and chemical synthesis.
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