Cas no 80463-21-4 (Benzaldehyde,4-(1-hydroxyethyl)-)
Benzaldehyde,4-(1-hydroxyethyl)- Chemical and Physical Properties
Names and Identifiers
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- Benzaldehyde,4-(1-hydroxyethyl)-
- 4-(1-hydroxy-ethyl)-benzaldehyde
- Benzaldehyde, 4-(1-hydroxyethyl)- (9CI)
- KPQCYFPPETYXOG-UHFFFAOYSA-N
- CS-0089331
- D74867
- 80463-21-4
- 4-(1-Hydroxyethyl)benzaldehyde
- SCHEMBL6200956
-
- Inchi: 1S/C9H10O2/c1-7(11)9-4-2-8(6-10)3-5-9/h2-7,11H,1H3
- InChI Key: KPQCYFPPETYXOG-UHFFFAOYSA-N
- SMILES: OC(C)C1C=CC(C=O)=CC=1
Computed Properties
- Exact Mass: 150.068079557g/mol
- Monoisotopic Mass: 150.068079557g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 126
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.9
- Topological Polar Surface Area: 37.3?2
Benzaldehyde,4-(1-hydroxyethyl)- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1159971-10g |
4-(1-Hydroxyethyl)benzaldehyde |
80463-21-4 | 98% | 10g |
¥32812.00 | 2024-07-28 |
Benzaldehyde,4-(1-hydroxyethyl)- Related Literature
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
Additional information on Benzaldehyde,4-(1-hydroxyethyl)-
Benzaldehyde, 4-(1-hydroxyethyl)- (CAS No. 80463-21-4): A Comprehensive Overview
Benzaldehyde, 4-(1-hydroxyethyl)-, identified by the Chemical Abstracts Service Number (CAS No.) 80463-21-4, is a significant compound in the realm of organic chemistry and pharmaceutical research. This molecule, characterized by its unique structural and functional properties, has garnered considerable attention due to its potential applications in various scientific and industrial domains. The compound's structure, featuring a benzaldehyde core substituted with a 1-hydroxyethyl group, imparts distinct chemical reactivity and biological relevance that make it a subject of extensive study.
The chemical structure of Benzaldehyde, 4-(1-hydroxyethyl)- can be described as a benzene ring conjugated with an aldehyde group (-CHO) at the fourth position, attached to an ethyl chain that terminates with a hydroxyl group (-OH). This configuration endows the molecule with both electrophilic and nucleophilic characteristics, enabling it to participate in a wide array of chemical reactions. The presence of the hydroxyl group enhances its solubility in polar solvents and contributes to its interaction with biological systems.
In recent years, Benzaldehyde, 4-(1-hydroxyethyl)- has been explored for its pharmacological potential. Studies have indicated that this compound exhibits mild analgesic and anti-inflammatory properties, primarily due to its ability to modulate certain enzymatic pathways. The hydroxyl group's ability to form hydrogen bonds with biological molecules suggests that it could interact with receptors or enzymes involved in pain perception and inflammation. This interaction is further enhanced by the electron-withdrawing nature of the benzaldehyde moiety, which can stabilize reactive intermediates during metabolic processes.
Moreover, research has highlighted the compound's role in chemical synthesis. Its unique structure makes it a valuable intermediate in the production of more complex molecules. For instance, the aldehyde group can undergo condensation reactions with amino acids or other carbonyl compounds to form Schiff bases or other heterocyclic structures. These derivatives often exhibit enhanced biological activity and have been investigated for their potential in drug development.
The pharmaceutical industry has shown particular interest in derivatives of Benzaldehyde, 4-(1-hydroxyethyl)- due to their potential as prodrugs or lead compounds for new therapeutic agents. Prodrugs are pharmacologically inactive compounds that are converted into active drugs within the body; the hydroxyl group in this compound could facilitate such transformations through enzymatic or non-enzymatic processes. Additionally, the benzaldehyde moiety can serve as a scaffold for designing molecules with specific pharmacokinetic profiles.
Recent advancements in computational chemistry have enabled more precise predictions of the behavior of Benzaldehyde, 4-(1-hydroxyethyl)- and its derivatives. Molecular modeling techniques have been employed to simulate interactions between this compound and biological targets, providing insights into its mechanism of action. These simulations have helped researchers identify key structural features that contribute to its biological activity and have guided the design of more effective analogs.
The synthesis of Benzaldehyde, 4-(1-hydroxyethyl)- is another area where innovation has been prominent. Modern synthetic methodologies have improved yield and purity while reducing environmental impact. Catalytic processes, for example, have allowed for more efficient production of this compound compared to traditional methods. Such advancements are crucial for scaling up production while maintaining high standards of quality control.
In conclusion, Benzaldehyde, 4-(1-hydroxyethyl)- (CAS No. 80463-21-4) is a multifaceted compound with significant implications in pharmaceutical research and chemical synthesis. Its unique structure and functional properties make it a valuable tool for developing new drugs and understanding biological processes. As research continues to uncover new applications for this compound, its importance in science and industry is likely to grow further.
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