Cas no 3212-67-7 (3-Pentanone,2-hydroxy-2,4-dimethyl-)
3-Pentanone,2-hydroxy-2,4-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 3-Pentanone,2-hydroxy-2,4-dimethyl-
- 2-hydroxy-2,4-dimethylpentan-3-one
- 2,4-Dimethyl-2-hydroxy-3-pentanone
- 2-Hydroxy-2,4-dimethyl-3-pentanone
- 3-Pentanone, 2-hydroxy-2,4-dimethyl-
- 2-Hydroxy-2,4-dimethy-3-pentanone
- SCHEMBL959198
- 3212-67-7
- DTXSID50338229
-
- Inchi: 1S/C7H14O2/c1-5(2)6(8)7(3,4)9/h5,9H,1-4H3
- InChI Key: XWJXXDDXZUVWBY-UHFFFAOYSA-N
- SMILES: OC(C)(C)C(C(C)C)=O
Computed Properties
- Exact Mass: 130.09942
- Monoisotopic Mass: 130.099379685g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 2
- Complexity: 114
- 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: 0.9
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.3
3-Pentanone,2-hydroxy-2,4-dimethyl- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 2076908-1g |
2-hydroxy-2,4-dimethylpentan-3-one |
3212-67-7 | 98% | 1g |
¥8927.00 | 2024-08-02 |
3-Pentanone,2-hydroxy-2,4-dimethyl- Related Literature
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Connor J. Taylor,Hikaru Seki,Friederike M. Dannheim,Mark J. Willis,Graeme Clemens,Brian A. Taylor,Thomas W. Chamberlain,Richard A. Bourne React. Chem. Eng., 2021,6, 1404-1411
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Robert P. Davies,Maria A. Giménez,Laura Patel,Andrew J. P. White Dalton Trans., 2008, 5705-5707
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3. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
Additional information on 3-Pentanone,2-hydroxy-2,4-dimethyl-
Chemical Profile of 3-Pentanone,2-hydroxy-2,4-dimethyl- (CAS No: 3212-67-7)
3-Pentanone,2-hydroxy-2,4-dimethyl-, identified by its Chemical Abstracts Service (CAS) number 3212-67-7, is a significant organic compound with a unique molecular structure that has garnered attention in various scientific and industrial applications. This compound belongs to the ketone class, characterized by a carbonyl group (C=O) adjacent to a methyl-substituted pentane backbone. The presence of hydroxyl and additional methyl groups at specific positions imparts distinct chemical properties, making it a versatile intermediate in synthetic chemistry and a subject of interest in pharmaceutical research.
The molecular formula of 3-Pentanone,2-hydroxy-2,4-dimethyl- is C7H12O, reflecting its composition of seven carbon atoms, twelve hydrogen atoms, and one oxygen atom. The structural arrangement of these atoms results in a compound with moderate polarity due to the hydroxyl group, which can participate in hydrogen bonding, while the methyl groups enhance its lipophilicity. This balance of polar and nonpolar characteristics makes it an effective solvent or reagent in organic synthesis.
In recent years, 3-Pentanone,2-hydroxy-2,4-dimethyl- has been explored for its potential applications in the pharmaceutical industry. Its structural motif is reminiscent of natural products found in plants and microorganisms, suggesting possible bioactive properties. For instance, derivatives of this compound have been investigated for their role as intermediates in the synthesis of enzyme inhibitors and other therapeutic agents. The hydroxyl group provides a site for further functionalization, allowing chemists to tailor the molecule for specific biological targets.
One notable area of research involves the use of 3-Pentanone,2-hydroxy-2,4-dimethyl- as a precursor in the development of novel antimicrobial agents. The increasing prevalence of antibiotic-resistant bacteria has driven the search for alternative treatments, and compounds with structural diversity offer new opportunities. Studies have shown that modifications to the hydroxyl and methyl groups can influence the antimicrobial efficacy of the molecule. Additionally, its ability to interact with biological membranes suggests potential applications in anti-inflammatory or anti-cancer therapies.
The industrial significance of 3-Pentanone,2-hydroxy-2,4-dimethyl- extends beyond pharmaceuticals into agrochemicals and specialty chemicals. Its reactivity makes it a valuable building block for synthesizing more complex molecules used in pesticides and herbicides. Furthermore, its role as a solvent in various chemical reactions underscores its utility in industrial processes where selectivity and efficiency are critical.
The synthesis of 3-Pentanone,2-hydroxy-2,4-dimethyl- typically involves multi-step organic reactions starting from readily available precursors such as 2-methylbutan-1-one. Advanced synthetic techniques like catalytic hydrogenation and oxidation have been optimized to improve yield and purity. Recent advancements in green chemistry have also focused on developing more sustainable methods for producing this compound without generating excessive waste or hazardous byproducts.
In conclusion, 3-Pentanone, with CAS No: 3212677, represents a fascinating compound with broad applications across multiple scientific disciplines. Its unique structure offers opportunities for innovation in drug discovery, material science, and industrial chemistry. As research continues to uncover new uses for this molecule, its importance is likely to grow further, driving both academic interest and commercial development.
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