Cas no 61348-28-5 (5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid)
5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid Chemical and Physical Properties
Names and Identifiers
-
- (R)-5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid
- Boc-D-glutamine
- Boc-D-Gln-OH
- N~2~-(tert-butoxycarbonyl)-L-glutamine
- N2-Boc-D-glutamine
- N-ALPHA-T-BUTOXYCARBONYL-D-GLUTAMINE
- (2R)-5-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoic acid
- Boc-D-Gln
- N-(tert-Butoxycarbonyl)-D-glutamine
- Boc-Gln-OH
- n(alpha)-boc-d-glutamine
- Boc-L-Gln-OH
- D-Glutamine, N2-[(1,1-dimethylethoxy)carbonyl]-
- nalpha-boc-d-glutamine
- PubChem12944
- n-alpha-boc-d-glutamine
- BOC-(D)-Gln-OH
- VVNYDCGZZSTUBC-ZCFIWIBFSA-N
- EBD41394
- KM0498
- n-alpha-t-butyloxycarbo
- 5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid
- FD21557
- SCHEMBL1486176
- Boc-D-Gln-OH, >=98.0%
- MFCD00038158
- AC-24106
- Q-101547
- (2R)-2-[(TERT-BUTOXYCARBONYL)AMINO]-4-CARBAMOYLBUTANOIC ACID
- (tert-Butoxycarbonyl)-D-glutamine
- DS-15187
- n-alpha-t-butyloxycarbonyl-d-glutamine
- 61348-28-5
- EN300-250374
- (R)-5-AMINO-2-(TERT-BUTOXYCARBONYLAMINO)-5-OXOPENTANOIC ACID
- CS-W012699
- (2R)-2-{[(tert-butoxy)carbonyl]amino}-4-carbamoylbutanoic acid
- AC-6938
- AKOS016843603
- PD196833
- N2-[(1,1-Dimethylethoxy)carbonyl]-D-glutamine; N-tert-Butoxycarbonyl-D-glutamine
- HY-W011983
-
- MDL: MFCD00038158
- Inchi: 1S/C10H18N2O5/c1-10(2,3)17-9(16)12-6(8(14)15)4-5-7(11)13/h6H,4-5H2,1-3H3,(H2,11,13)(H,12,16)(H,14,15)/t6-/m1/s1
- InChI Key: VVNYDCGZZSTUBC-ZCFIWIBFSA-N
- SMILES: O(C(N([H])[C@@]([H])(C(=O)O[H])C([H])([H])C([H])([H])C(N([H])[H])=O)=O)C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H]
- BRN: 1981311
Computed Properties
- Exact Mass: 246.12200
- Monoisotopic Mass: 246.122
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 7
- Complexity: 308
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: -1
- Tautomer Count: 4
- XLogP3: 0.6
- Topological Polar Surface Area: 119
Experimental Properties
- Color/Form: White solid
- Density: 1.2430 (rough estimate)
- Melting Point: 117-119°C
- Boiling Point: 509.1℃ at 760 mmHg
- Flash Point: 261.7 °C
- Refractive Index: 1.4550 (estimate)
- Solubility: Soluble, 1mmol in 2mL DMF. Soluble in chloroform and methanol.
- PSA: 118.72000
- LogP: 1.32100
- Solubility: Soluble in water (4.25g/100ml, 25 ℃), the aqueous solution is acidic, almost insoluble in ethanol, insoluble in ether, methanol, benzene, acetone, chloroform, ethyl acetate and glacial acetic acid.
5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid Security Information
- WGK Germany:3
- Safety Instruction: S24/25
- HazardClass:IRRITANT
- Safety Term:S24/25
- Storage Condition:Store in cold storage.
5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 019577-1g |
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61348-28-5 | 98% | 1g |
£12.00 | 2022-02-28 | |
| Fluorochem | 019577-5g |
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61348-28-5 | 98% | 5g |
£35.00 | 2022-02-28 | |
| Fluorochem | 019577-10g |
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£67.00 | 2022-02-28 | |
| Fluorochem | 019577-25g |
Boc-D-Gln |
61348-28-5 | 98% | 25g |
£119.00 | 2022-02-28 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | B137298-100g |
5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid |
61348-28-5 | 98% | 100g |
¥1990.90 | 2023-09-04 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | B137298-1g |
5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid |
61348-28-5 | 98% | 1g |
¥41.90 | 2023-09-04 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | B137298-250mg |
5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid |
61348-28-5 | 98% | 250mg |
¥29.90 | 2023-09-04 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | B137298-25g |
5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid |
61348-28-5 | 98% | 25g |
¥642.90 | 2023-09-04 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | B137298-5g |
5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid |
61348-28-5 | 98% | 5g |
¥185.90 | 2023-09-04 | |
| Chemenu | CM254028-1000g |
Boc-D-Gln-OH |
61348-28-5 | 95+% | 1000g |
$2880 | 2021-06-09 |
5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid Suppliers
5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid Related Literature
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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5. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
Additional information on 5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid
Introduction to 5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic Acid (CAS No. 61348-28-5)
5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid
is a significant compound in the field of pharmaceutical chemistry, widely recognized for its versatile applications in drug synthesis and biochemical research. This compound, identified by its CAS number 61348-28-5, has garnered considerable attention due to its structural complexity and functional diversity. The presence of multiple reactive sites, including amino and carboxyl groups, as well as the protective tert-butoxycarbonyl (Boc) group, makes it a valuable intermediate in the development of various therapeutic agents.
The compound's structure, featuring a five-carbon chain with functional groups at specific positions, allows for a wide range of chemical modifications. These modifications are crucial in the synthesis of more complex molecules, particularly in the realm of peptidomimetics and protease inhibitors. The Boc group, in particular, serves as an important protecting group that can be selectively removed under specific conditions, facilitating controlled synthesis pathways.
In recent years, there has been a surge in research focused on the development of novel antibiotics and antiviral agents. 5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid has emerged as a key building block in these efforts. Its ability to undergo various reactions, such as condensation, cyclization, and nucleophilic substitution, makes it an ideal candidate for constructing complex molecular architectures. For instance, it has been utilized in the synthesis of cyclic peptides that mimic natural bioactive molecules, which are known to exhibit potent antimicrobial properties.
The compound's role in drug discovery is further highlighted by its application in the development of protease inhibitors. Proteases are enzymes that play a critical role in various biological processes, including viral replication and inflammation. Inhibiting these enzymes has been a major strategy in the treatment of diseases such as HIV/AIDS and cancer. The structural features of 5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid allow for the design of molecules that can specifically target and inhibit certain proteases, thereby offering potential therapeutic benefits.
Advances in computational chemistry have also contributed to the growing interest in this compound. Molecular modeling studies have demonstrated its potential as a scaffold for drug design, providing insights into its interactions with biological targets. These studies often involve sophisticated algorithms and high-performance computing resources to predict how the compound might behave within a biological system. Such predictions are invaluable for guiding experimental efforts and optimizing drug candidates.
The synthesis of 5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid involves multi-step organic reactions that require precise control over reaction conditions. The use of high-purity starting materials and catalysts is essential to ensure high yields and minimal side products. Researchers have developed efficient synthetic routes that leverage modern techniques such as flow chemistry and microwave-assisted synthesis to improve reaction efficiency and scalability.
In addition to its pharmaceutical applications, this compound has found utility in other areas of chemical research. For example, it serves as a precursor in the synthesis of advanced materials with unique properties. These materials may find applications in electronics, coatings, and other high-tech industries where precise molecular control is required.
The growing body of research on 5-Amino-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid underscores its importance as a versatile chemical entity. As our understanding of biological systems continues to expand, so does the demand for sophisticated molecular tools like this one. Future studies are likely to explore new synthetic methodologies and applications that will further enhance its value in both academic and industrial settings.
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