Cas no 50390-51-7 (1-Propanone,2-methyl-1-(4-methylphenyl)-)
1-Propanone,2-methyl-1-(4-methylphenyl)- Chemical and Physical Properties
Names and Identifiers
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- 1-Propanone,2-methyl-1-(4-methylphenyl)-
- 2,4'-dimethylpropiophenone
- 2-methyl-1-(4-methylphenyl)propan-1-one
- 1-(4-methylphenyl)-2-methyl-1-propanone
- 2-methyl-1-(p-tolyl)propan-1-one
- 4'-methylphenyl isopropyl ketone
- EINECS 256-572-9
- isopropyl 4-methylphenyl ketone
- p-tolyl isopropyl ketone
-
- MDL: MFCD00032353
- Inchi: InChI=1S/C11H14O/c1-8(2)11(12)10-6-4-9(3)5-7-10/h4-8H,1-3H3
- InChI Key: VLKIRFAISMBUCB-UHFFFAOYSA-N
- SMILES: CC(C)C(=O)C1=CC=C(C)C=C1
Computed Properties
- Exact Mass: 162.10400
- Monoisotopic Mass: 162.104465
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 152
- 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
- Surface Charge: 0
- Tautomer Count: 7
- XLogP3: nothing
- Topological Polar Surface Area: 17.1
Experimental Properties
- Density: 0.95
- Boiling Point: 242.1 °C at 760 mmHg
- Flash Point: 94.3 °
- Refractive Index: 1.501
- PSA: 17.07000
- LogP: 2.83370
1-Propanone,2-methyl-1-(4-methylphenyl)- Customs Data
- HS CODE:2914399090
- Customs Data:
China Customs Code:
2914399090Overview:
2914399090. Other aromatic ketones without other oxygen-containing groups. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:5.5%. general tariff:30.0%
Declaration elements:
Product Name, component content, use to, Acetone declared packaging
Summary:
2914399090. other aromatic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%
1-Propanone,2-methyl-1-(4-methylphenyl)- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| abcr | AB433310-1 g |
2,4'-Dimethylpropiophenone |
50390-51-7 | 1g |
€387.80 | 2022-03-02 | ||
| abcr | AB433310-5 g |
2,4'-Dimethylpropiophenone |
50390-51-7 | 5g |
€732.00 | 2022-03-02 | ||
| Crysdot LLC | CD12067413-1g |
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50390-51-7 | 95+% | 1g |
$356 | 2024-07-24 | |
| Crysdot LLC | CD12067413-5g |
2-Methyl-1-(p-tolyl)propan-1-one |
50390-51-7 | 95+% | 5g |
$699 | 2024-07-24 | |
| Crysdot LLC | CD12067413-10g |
2-Methyl-1-(p-tolyl)propan-1-one |
50390-51-7 | 95+% | 10g |
$1121 | 2024-07-24 | |
| Crysdot LLC | CD12067413-25g |
2-Methyl-1-(p-tolyl)propan-1-one |
50390-51-7 | 95+% | 25g |
$2087 | 2024-07-24 | |
| A2B Chem LLC | AD18841-1g |
2-Methyl-1-(p-tolyl)propan-1-one |
50390-51-7 | 1g |
$486.00 | 2024-04-19 | ||
| A2B Chem LLC | AD18841-5g |
2-Methyl-1-(p-tolyl)propan-1-one |
50390-51-7 | 5g |
$1003.00 | 2024-04-19 | ||
| Ambeed | A592902-1g |
2-Methyl-1-(p-tolyl)propan-1-one |
50390-51-7 | 95+% | 1g |
$342.0 | 2024-08-02 | |
| eNovation Chemicals LLC | Y1055792-5g |
2-methyl-1-(p-tolyl)propan-1-one |
50390-51-7 | 95% | 5g |
$1000 | 2025-02-26 |
1-Propanone,2-methyl-1-(4-methylphenyl)- Suppliers
1-Propanone,2-methyl-1-(4-methylphenyl)- Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
Additional information on 1-Propanone,2-methyl-1-(4-methylphenyl)-
1-Propanone,2-methyl-1-(4-methylphenyl)- (CAS No. 50390-51-7): A Comprehensive Overview
1-Propanone,2-methyl-1-(4-methylphenyl)-, also known by its CAS registry number 50390-51-7, is a versatile organic compound with significant applications in various fields of chemistry. This compound belongs to the class of ketones, specifically propanones, and exhibits a unique structure that makes it valuable in both academic research and industrial processes. The molecule consists of a propanone backbone with a methyl group at the second carbon and a substituted phenyl group at the first carbon position. The phenyl group is further substituted with a methyl group at the para position, giving it additional stability and reactivity.
The synthesis of 1-Propanone,2-methyl-1-(4-methylphenyl)- can be achieved through several methods, including the Friedel-Crafts acylation reaction and other ketone-forming processes. Recent studies have explored the use of transition metal catalysts to enhance the efficiency and selectivity of these reactions. For instance, researchers have reported the use of palladium-catalyzed cross-coupling reactions to synthesize this compound with high yields and purity. These advancements have not only improved the production process but also opened new avenues for its application in drug discovery and material science.
One of the most notable applications of 1-Propanone,2-methyl-1-(4-methylphenyl)- is in the field of medicinal chemistry. The compound serves as a valuable intermediate in the synthesis of various bioactive molecules. For example, it has been used in the development of anti-inflammatory agents and antioxidants due to its ability to participate in nucleophilic addition reactions. Recent research has highlighted its potential as a precursor for designing novel kinase inhibitors, which are critical in cancer therapy.
In addition to its medicinal applications, 1-Propanone,2-methyl-1-(4-methylphenyl)- has found significant use in organic synthesis as a building block for constructing complex molecular frameworks. Its reactivity towards enolate formation makes it an ideal substrate for aldol reactions and other carbonyl chemistry transformations. Furthermore, the compound has been employed in the synthesis of heterocyclic compounds, which are essential components in many pharmaceuticals and agrochemicals.
The physical properties of 1-Propanone,2-methyl-1-(4-methylphenyl)- are well-documented. It is a yellowish liquid with a pleasant odor and is sparingly soluble in water but highly soluble in organic solvents such as dichloromethane and ethyl acetate. Its melting point is approximately -30°C, and its boiling point is around 85°C under standard atmospheric pressure. These properties make it suitable for use in various chemical processes that require precise control over temperature and solubility.
From an environmental perspective, 1-Propanone,2-methyl-1-(4-methylphenyl)- has been studied for its biodegradability and potential impact on ecosystems. Recent studies indicate that it undergoes rapid biodegradation under aerobic conditions, making it less persistent in the environment compared to other organic compounds. However, further research is needed to fully understand its ecological footprint and ensure sustainable practices during its production and use.
In conclusion, 1-Propanone,2-methyl-1-(4-methylphenyl)- (CAS No. 50390-51-7) is a multifaceted compound with wide-ranging applications across various disciplines. Its unique chemical structure, reactivity, and physical properties make it an invaluable tool in both academic research and industrial processes. As ongoing research continues to uncover new insights into its synthesis, applications, and environmental impact, this compound is poised to play an even more significant role in advancing modern chemistry.
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