Cas no 42206-47-3 (2-Methyl-2-(4-nitrophenyl)propanoic acid)
2-Methyl-2-(4-nitrophenyl)propanoic acid Chemical and Physical Properties
Names and Identifiers
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- 2-METHYL-2-(4-NITROPHENYL)-PROPIONIC ACID
- 2-Methyl-2-(4-nitrophenyl)propanoic acid
- 2-methyl-2-(4-nitrophenyl)propionic acid
- 2-(4-nitrophenyl)-2-methylpropionic acid
- 2-methyl-2-(4-nitro-phenyl)-propionic acid
- 2-Methyl-2-(4-nitro-phenyl)-propionsaeure
- AC1LFPLS
- AC1Q1Z59
- CBMicro_020116
- CTK4I5853
- methylnitrophenylpropanoicacid
- Oprea1_400679
- SureCN1646651
- Cambridge id 5406164
- AFRRWJPNQKSTEY-UHFFFAOYSA-N
- SBB094167
- 3080AE
- PB12705
- RP12170
- 2-(4-nitrophenyl)-2-methylpropionic ac
- AB0075827
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- MDL: MFCD00816185
- Inchi: 1S/C10H11NO4/c1-10(2,9(12)13)7-3-5-8(6-4-7)11(14)15/h3-6H,1-2H3,(H,12,13)
- InChI Key: AFRRWJPNQKSTEY-UHFFFAOYSA-N
- SMILES: OC(C(C)(C)C1C=CC(=CC=1)[N+](=O)[O-])=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 261
- Topological Polar Surface Area: 83.1
Experimental Properties
- Color/Form: Pale-yellow to Yellow-brown Solid
- Boiling Point: 365.9℃ at 760 mmHg
2-Methyl-2-(4-nitrophenyl)propanoic acid Security Information
- Signal Word:Warning
- Hazard Statement: H302;H315;H319;H335
- Warning Statement: P261;P280;P301+P312;P302+P352;P305+P351+P338
- HazardClass:IRRITANT
- Storage Condition:Room temperature
2-Methyl-2-(4-nitrophenyl)propanoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | 048300-500mg |
2-Methyl-2-(4-nitrophenyl)propanoic acid |
42206-47-3 | >95% | 500mg |
2291CNY | 2021-05-07 | |
| Alichem | A019108853-1g |
2-Methyl-2-(4-nitrophenyl)propanoic acid |
42206-47-3 | 97% | 1g |
$168.30 | 2023-09-01 | |
| Alichem | A019108853-5g |
2-Methyl-2-(4-nitrophenyl)propanoic acid |
42206-47-3 | 97% | 5g |
$554.49 | 2023-09-01 | |
| Alichem | A019108853-25g |
2-Methyl-2-(4-nitrophenyl)propanoic acid |
42206-47-3 | 97% | 25g |
$1562.08 | 2023-09-01 | |
| Fluorochem | 040587-1g |
2-Methyl-2-(4-nitrophenyl)-propionic acid |
42206-47-3 | 97% | 1g |
£118.00 | 2022-03-01 | |
| Fluorochem | 040587-5g |
2-Methyl-2-(4-nitrophenyl)-propionic acid |
42206-47-3 | 97% | 5g |
£483.00 | 2022-03-01 | |
| Fluorochem | 040587-25g |
2-Methyl-2-(4-nitrophenyl)-propionic acid |
42206-47-3 | 97% | 25g |
£1690.00 | 2022-03-01 | |
| AstaTech | 59237-1/G |
2-METHYL-2-(4-NITROPHENYL)-PROPIONIC ACID |
42206-47-3 | 97% | 1/G |
$143 | 2022-06-01 | |
| AstaTech | 59237-5/G |
2-METHYL-2-(4-NITROPHENYL)-PROPIONIC ACID |
42206-47-3 | 97% | 5g |
$59 | 2023-09-16 | |
| AstaTech | 59237-25/G |
2-METHYL-2-(4-NITROPHENYL)-PROPIONIC ACID |
42206-47-3 | 97% | 25g |
$299 | 2023-09-16 |
2-Methyl-2-(4-nitrophenyl)propanoic acid Suppliers
2-Methyl-2-(4-nitrophenyl)propanoic acid Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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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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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
Additional information on 2-Methyl-2-(4-nitrophenyl)propanoic acid
Comprehensive Overview of 2-Methyl-2-(4-nitrophenyl)propanoic acid (CAS No. 42206-47-3)
2-Methyl-2-(4-nitrophenyl)propanoic acid (CAS No. 42206-47-3) is a specialized organic compound widely recognized in pharmaceutical and chemical research. This compound, characterized by its nitrophenyl and propanoic acid functional groups, plays a pivotal role in synthetic chemistry, particularly in the development of intermediates for bioactive molecules. Its unique structure, featuring a methyl group and a nitro substituent, makes it a valuable building block for designing novel compounds with potential applications in medicinal chemistry and material science.
In recent years, the demand for 2-Methyl-2-(4-nitrophenyl)propanoic acid has surged due to its relevance in drug discovery and organic synthesis. Researchers are increasingly exploring its utility in creating enzyme inhibitors and anti-inflammatory agents, aligning with the growing interest in targeted therapies. The compound’s CAS No. 42206-47-3 is frequently searched in academic databases and chemical supplier platforms, reflecting its importance in high-value research. Additionally, its nitrophenyl moiety is often highlighted in studies focusing on photocatalysis and green chemistry, addressing the global push for sustainable synthetic methods.
The synthesis of 2-Methyl-2-(4-nitrophenyl)propanoic acid typically involves Friedel-Crafts acylation or carboxylation reactions, with optimization protocols being a hot topic in peer-reviewed journals. Its crystalline form and solubility profiles are critical for formulation scientists, especially those working on biocompatible polymers or drug delivery systems. Analytical techniques like HPLC and NMR spectroscopy are routinely employed to verify its purity, a key concern for laboratories adhering to Good Manufacturing Practices (GMP).
From an industrial perspective, CAS No. 42206-47-3 is often discussed in the context of scale-up challenges and cost-effective production. Innovations in continuous flow chemistry have been proposed to enhance its synthesis efficiency, reducing waste and energy consumption—a priority for ESG (Environmental, Social, and Governance)-compliant manufacturers. Furthermore, the compound’s patent landscape reveals its inclusion in proprietary formulations, particularly in agrochemicals and specialty chemicals, underscoring its cross-sectoral utility.
For researchers querying "nitrophenyl derivatives applications" or "propanoic acid synthesis," 2-Methyl-2-(4-nitrophenyl)propanoic acid serves as a prime example of structural versatility. Its electron-withdrawing nitro group facilitates diverse electrophilic substitutions, while its carboxylic acid functionality enables further derivatization. These attributes are frequently explored in computational chemistry studies, where molecular docking simulations predict its interactions with biological targets.
In conclusion, 2-Methyl-2-(4-nitrophenyl)propanoic acid (CAS No. 42206-47-3) exemplifies the intersection of fundamental research and applied science. Its multifaceted roles—from pharmaceutical intermediates to material science precursors—make it a compound of enduring interest. As industries and academia prioritize sustainability and innovation, this molecule is poised to remain at the forefront of organic chemistry advancements.
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