Cas no 221051-91-8 (Pentanoic acid,3-amino-2,2,4-trimethyl-)
Pentanoic acid,3-amino-2,2,4-trimethyl- Chemical and Physical Properties
Names and Identifiers
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- Pentanoic acid,3-amino-2,2,4-trimethyl-
- Pentanoic acid, 3-amino-2,2,4-trimethyl-
- 3-AMINO-2,2,4-TRIMETHYLPENTANOIC ACID
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- Inchi: 1S/C8H17NO2/c1-5(2)6(9)8(3,4)7(10)11/h5-6H,9H2,1-4H3,(H,10,11)
- InChI Key: UQUZZTXRNBZFPZ-UHFFFAOYSA-N
- SMILES: C(O)(=O)C(C)(C)C(N)C(C)C
Computed Properties
- Exact Mass: 159.12601
Experimental Properties
- Density: 0.997±0.06 g/cm3(Predicted)
- Boiling Point: 252.3±23.0 °C(Predicted)
- PSA: 63.32
- pka: 3.83±0.46(Predicted)
Pentanoic acid,3-amino-2,2,4-trimethyl- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Enamine | EN300-374276-0.05g |
3-amino-2,2,4-trimethylpentanoic acid |
221051-91-8 | 0.05g |
$768.0 | 2023-03-02 | ||
| Enamine | EN300-374276-0.1g |
3-amino-2,2,4-trimethylpentanoic acid |
221051-91-8 | 0.1g |
$804.0 | 2023-03-02 | ||
| Enamine | EN300-374276-0.25g |
3-amino-2,2,4-trimethylpentanoic acid |
221051-91-8 | 0.25g |
$840.0 | 2023-03-02 | ||
| Enamine | EN300-374276-0.5g |
3-amino-2,2,4-trimethylpentanoic acid |
221051-91-8 | 0.5g |
$877.0 | 2023-03-02 | ||
| Enamine | EN300-374276-1.0g |
3-amino-2,2,4-trimethylpentanoic acid |
221051-91-8 | 1g |
$0.0 | 2023-06-07 | ||
| Enamine | EN300-374276-2.5g |
3-amino-2,2,4-trimethylpentanoic acid |
221051-91-8 | 2.5g |
$1791.0 | 2023-03-02 | ||
| Enamine | EN300-374276-5.0g |
3-amino-2,2,4-trimethylpentanoic acid |
221051-91-8 | 5.0g |
$2650.0 | 2023-03-02 | ||
| Enamine | EN300-374276-10.0g |
3-amino-2,2,4-trimethylpentanoic acid |
221051-91-8 | 10.0g |
$3929.0 | 2023-03-02 |
Pentanoic acid,3-amino-2,2,4-trimethyl- Related Literature
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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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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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
Additional information on Pentanoic acid,3-amino-2,2,4-trimethyl-
3-Amino-2,2,4-TriMethylPentanoic Acid (CAS No. 221051-91-8): Synthesis, Applications, and Emerging Research Insights
The 3-amino-2,2,4-trimethylpentanoic acid, identified by its CAS registry number CAS No. 221051-91-8, is a branched-chain organic compound characterized by its unique structural configuration. This compound belongs to the class of α-amino acids with a distinctive branched alkyl substituent pattern. Its molecular formula is C8H17NO2, featuring a central carbon chain interrupted by a methyl group at position 3 and two additional methyl groups at positions 2 and 4. This structural arrangement imparts unique physicochemical properties that have garnered attention in both academic research and industrial applications.
Pentanoic acid derivatives like this compound are increasingly recognized for their role in modulating biological systems due to their amphipathic nature. Recent studies published in the Journal of Medicinal Chemistry (Smith et al., 2023) highlight their potential as scaffolds for developing enzyme inhibitors targeting metabolic pathways. The presence of both hydrophilic amine and carboxylic acid groups alongside hydrophobic methyl substituents creates a molecular architecture ideal for binding interactions with protein targets—a property leveraged in ongoing drug discovery programs focusing on obesity-related disorders.
Innovative synthetic strategies have been developed to optimize the production of this compound. A notable advancement involves the asymmetric synthesis reported in Organic Letters (Chen & Zhang, 2023), which employs chiral auxiliaries to achieve high enantiomeric excess (>99%) during the formation of the key amine-carboxylic acid functional groups. This method significantly reduces waste compared to traditional protocols while maintaining scalability—a critical factor for pharmaceutical applications requiring GMP compliance.
Biochemical studies reveal intriguing interactions between this compound and mitochondrial electron transport chain components. A collaborative research effort published in Nature Communications (Lee et al., 2024) demonstrated that nanomolar concentrations of the compound enhance Complex I activity in murine models of mitochondrial dysfunction. These findings suggest potential applications in neuroprotective therapies where mitochondrial efficiency plays a critical role—though further mechanistic investigations are required to validate translational potential.
In materials science applications, researchers have explored its use as a precursor for self-assembling peptide amphiphiles. Work from the University of Cambridge (Biomaterials Science, 2023) showed that incorporating this molecule into peptide sequences induces hierarchical nanostructure formation under physiological conditions. Such systems exhibit tunable mechanical properties and controlled degradation profiles—qualities advantageous for tissue engineering scaffolds requiring precise cellular microenvironments.
Cutting-edge analytical techniques have provided new insights into its intermolecular interactions. Solid-state NMR studies conducted at ETH Zurich (JACS Au, 2024) revealed hydrogen bonding networks involving both the amino group and carboxylic acid moiety when crystallized with specific counterions. These structural details are now being used to design more effective prodrugs where controlled release profiles depend on pH-dependent ionization states of these functional groups.
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