Cas no 27855-91-0 (2-[(1-formylnaphthalen-2-yl)oxy]acetic acid)
2-[(1-formylnaphthalen-2-yl)oxy]acetic acid Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid, [(1-formyl-2-naphthalenyl)oxy]-
- (1-formyl-2-naphthyloxy)acetic acid
- 2-[(1-formylnaphthalen-2-yl)oxy]acetic acid
- AKOS002681293
- 27855-91-0
- 2-(1-formylnaphthalen-2-yl)oxyacetic Acid
- 2-((1-Formylnaphthalen-2-yl)oxy)acetic acid
- SCHEMBL2560912
- CS-0450582
- Z234897229
- 2-((1-Formylnaphthalen-2-yl)oxy)aceticacid
-
- Inchi: 1S/C13H10O4/c14-7-11-10-4-2-1-3-9(10)5-6-12(11)17-8-13(15)16/h1-7H,8H2,(H,15,16)
- InChI Key: KPXVRLWYIOYSPZ-UHFFFAOYSA-N
- SMILES: O(CC(=O)O)C1=CC=C2C=CC=CC2=C1C=O
Computed Properties
- Exact Mass: 230.0579
- Monoisotopic Mass: 230.05790880g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 289
- 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: 2.2
- Topological Polar Surface Area: 63.6?2
Experimental Properties
- PSA: 63.6
2-[(1-formylnaphthalen-2-yl)oxy]acetic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM246553-1g |
2-((1-Formylnaphthalen-2-yl)oxy)acetic acid |
27855-91-0 | 97% | 1g |
$309 | 2021-08-04 | |
| Chemenu | CM246553-5g |
2-((1-Formylnaphthalen-2-yl)oxy)acetic acid |
27855-91-0 | 97% | 5g |
$884 | 2021-08-04 | |
| Chemenu | CM246553-10g |
2-((1-Formylnaphthalen-2-yl)oxy)acetic acid |
27855-91-0 | 97% | 10g |
$1216 | 2021-08-04 | |
| TRC | F786380-10mg |
2-[(1-Formylnaphthalen-2-yl)oxy]acetic Acid |
27855-91-0 | 10mg |
$ 50.00 | 2022-06-04 | ||
| TRC | F786380-50mg |
2-[(1-Formylnaphthalen-2-yl)oxy]acetic Acid |
27855-91-0 | 50mg |
$ 160.00 | 2022-06-04 | ||
| TRC | F786380-100mg |
2-[(1-Formylnaphthalen-2-yl)oxy]acetic Acid |
27855-91-0 | 100mg |
$ 250.00 | 2022-06-04 | ||
| Chemenu | CM246553-1g |
2-((1-Formylnaphthalen-2-yl)oxy)acetic acid |
27855-91-0 | 97% | 1g |
$297 | 2024-07-28 | |
| NAN JING YAO SHI KE JI GU FEN Co., Ltd. | PBTQ0264-1G |
2-[(1-formylnaphthalen-2-yl)oxy]acetic acid |
27855-91-0 | 95% | 1g |
¥ 1,993.00 | 2023-04-13 | |
| Ambeed | A656943-1g |
2-((1-Formylnaphthalen-2-yl)oxy)acetic acid |
27855-91-0 | 98% | 1g |
$304.0 | 2024-07-28 | |
| NAN JING YAO SHI KE JI GU FEN Co., Ltd. | PBTQ0264-100mg |
2-[(1-formylnaphthalen-2-yl)oxy]acetic acid |
27855-91-0 | 95% | 100mg |
¥599.0 | 2024-04-20 |
2-[(1-formylnaphthalen-2-yl)oxy]acetic acid Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
Additional information on 2-[(1-formylnaphthalen-2-yl)oxy]acetic acid
Professional Introduction to 2-[(1-formylnaphthalen-2-yl)oxy]acetic Acid (CAS No. 27855-91-0)
2-[(1-formylnaphthalen-2-yl)oxy]acetic acid, with the chemical formula C??H?NO?, is a significant compound in the field of pharmaceutical chemistry and bioorganic synthesis. This compound, identified by its CAS number 27855-91-0, has garnered attention due to its versatile applications in the development of novel therapeutic agents and biochemical research. The structural integrity of this molecule, featuring a naphthalene core substituted with a formyl group and an oxyacetic acid moiety, makes it a valuable intermediate in synthetic chemistry.
The naphthalene ring in 2-[(1-formylnaphthalen-2-yl)oxy]acetic acid serves as a scaffold for further functionalization, enabling the creation of complex derivatives that exhibit a wide range of biological activities. The formyl group (-CHO) attached to the naphthalene ring enhances the reactivity of the molecule, making it susceptible to condensation reactions and the formation of Schiff bases, which are widely used in medicinal chemistry. Additionally, the oxyacetic acid portion introduces acidic properties, facilitating interactions with biological targets such as enzymes and receptors.
In recent years, 2-[(1-formylnaphthalen-2-yl)oxy]acetic acid has been explored for its potential in drug discovery. Its structural features make it an attractive candidate for designing molecules that can modulate various biological pathways. For instance, studies have shown that derivatives of this compound may exhibit anti-inflammatory, antioxidant, and anticancer properties. The ability to derivatize the naphthalene core allows researchers to fine-tune the pharmacokinetic and pharmacodynamic profiles of potential drug candidates.
One of the most compelling aspects of 2-[(1-formylnaphthalen-2-yl)oxy]acetic acid is its role in the synthesis of biologically active molecules. The formyl group can undergo nucleophilic addition reactions, forming amides or imines with various nitrogen-containing heterocycles. These reactions are fundamental in constructing complex organic molecules that mimic natural products and have therapeutic potential. Furthermore, the oxyacetic acid moiety can participate in esterification or amidation reactions, expanding the synthetic possibilities for this compound.
Recent advancements in computational chemistry have also highlighted the importance of 2-[(1-formylnaphthalen-2-yl)oxy]acetic acid in drug design. Molecular modeling studies have demonstrated that this compound can interact with specific targets in high affinity binding pockets. These interactions are critical for understanding how potential drugs function at the molecular level and for predicting their efficacy and selectivity. The integration of experimental data with computational predictions has led to more informed decisions in medicinal chemistry research.
The pharmaceutical industry has taken notice of the potential applications of 2-[(1-formylnaphthalen-2-yl)oxy]acetic acid. Several companies are currently investigating its use as a building block for novel therapeutics. The compound's versatility and reactivity make it suitable for a wide range of drug development programs, from small-molecule inhibitors to peptidomimetics. As research continues to uncover new biological functions and synthetic pathways, the importance of this compound is likely to grow.
In academic research, 2-[(1-formylnaphthalen-2-yl)oxy]acetic acid has been utilized as a model system for studying reaction mechanisms and developing new synthetic methodologies. Its unique structural features provide an excellent platform for exploring transition metal-catalyzed reactions, such as cross-coupling and oxidation processes. These studies not only contribute to our fundamental understanding of organic chemistry but also lay the groundwork for more efficient synthetic routes in drug discovery.
The environmental impact of using 2-[(1-formylnaphthalen-2-yl)oxy]acetic acid in pharmaceutical research is also a topic of interest. Efforts are being made to develop sustainable synthetic protocols that minimize waste and reduce energy consumption. Green chemistry principles are being applied to optimize reactions involving this compound, ensuring that future drug development programs are both effective and environmentally responsible.
Looking ahead, the future prospects for 2-[1-formylnaphthalen-2-yl]oxy]acetic acid appear promising. As our understanding of biological systems continues to evolve, new opportunities will arise for exploiting its chemical properties. Advances in biotechnology and synthetic biology may further enhance its utility in creating next-generation therapeutics. The continued exploration of this compound will undoubtedly contribute to significant breakthroughs in medicine and chemical science.
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