Cas no 77191-38-9 (3-(2-Oxopyrrolidin-1-yl)propanoic acid)
3-(2-Oxopyrrolidin-1-yl)propanoic acid Chemical and Physical Properties
Names and Identifiers
-
- 3-(2-Oxopyrrolidin-1-yl)propanoic acid
- 1-Pyrrolidinepropanoicacid, 2-oxo-
- 3-(2-Oxo-pyrrolidin-1-yl)-propionic acid
- 3-(2-oxo-1-pyrrolidinyl)propionic acid
- 3-(2-oxopyrrolidin-1-yl)propionic acid
- 3-(2-oxo-pyrrolidino)-propionic acid
- 3-(2-Oxo-pyrrolidino)-propionsaeure
- 3-(2-oxopyrrolidinyl)propanoic acid
- 3-(2'-pyrrolidone)-propionic acid
- AC1MK0L8
- AC1Q75LR
- CTK2H8994
- SBB046364
- SureCN443220
- 2-Oxo-1-pyrrolidinepropanoic acid
- 2-Oxo-1-pyrrolidinepropionic acid
- 3-(2-oxo-1-pyrrolidinyl)propanoic acid
- BAS 03320419
- 1-Pyrrolidinepropanoic acid, 2-oxo-
- 9528AE
- BBL013242
- STK502201
- 3-(2-oxopyrrolidin-1-yl)propanoicacid
- 3-(2-Oxo-pyrrolidin-1-yl)propanoic acid
- DB-
- XOMYTIUVNSWEAI-UHFFFAOYSA-N
- A903697
- BB 0240348
- SCHEMBL443220
- FT-0677235
- MFCD05237379
- 3-(2-oxopyrrolidin-1-yl)propanoic acid, AldrichCPR
- Z240085326
- CS-0147737
- AKOS000146255
- AS-30271
- AO-365/41115408
- 3-(2-OXO-PYRROLIDIN-1-YL)-PROPIONICACID
- SY079236
- 77191-38-9
- DTXSID70998445
- EN300-67191
- DB-031902
- XH1256
- ALBB-000119
-
- MDL: MFCD05237379
- Inchi: 1S/C7H11NO3/c9-6-2-1-4-8(6)5-3-7(10)11/h1-5H2,(H,10,11)
- InChI Key: XOMYTIUVNSWEAI-UHFFFAOYSA-N
- SMILES: O=C1CCCN1CCC(=O)O
Computed Properties
- Exact Mass: 157.07400
- Monoisotopic Mass: 157.074
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 179
- 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: -0.7
- Topological Polar Surface Area: 57.6
Experimental Properties
- Density: 1.277
- Boiling Point: 366.3°C at 760 mmHg
- Flash Point: 175.4°C
- Refractive Index: 1.522
- PSA: 57.61000
- LogP: 0.02140
3-(2-Oxopyrrolidin-1-yl)propanoic acid Security Information
-
Symbol:
- Signal Word:Danger
- Hazard Statement: H318
- Warning Statement: P280-P305+P351+P338
- Hazardous Material transportation number:NONH for all modes of transport
- Hazard Category Code: 41
- Safety Instruction: 26-39
-
Hazardous Material Identification:
- HazardClass:IRRITANT
3-(2-Oxopyrrolidin-1-yl)propanoic acid Customs Data
- HS CODE:2933790090
- Customs Data:
China Customs Code:
2933790090Overview:
2933790090 Other lactams. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:9.0% general tariff:20.0%
Declaration elements:
Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date
Summary:
2933790090. other lactams. VAT:17.0%. Tax rebate rate:9.0%. . MFN tariff:9.0%. General tariff:20.0%
3-(2-Oxopyrrolidin-1-yl)propanoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 028649-1g |
3-(2-Oxo-pyrrolidin-1-yl)-propionic acid |
77191-38-9 | 95% | 1g |
£97.00 | 2022-03-01 | |
| Fluorochem | 028649-10g |
3-(2-Oxo-pyrrolidin-1-yl)-propionic acid |
77191-38-9 | 95% | 10g |
£437.00 | 2022-03-01 | |
| Alichem | A109007725-5g |
3-(2-Oxopyrrolidin-1-yl)propanoic acid |
77191-38-9 | 95% | 5g |
$297.99 | 2023-09-01 | |
| Alichem | A109007725-10g |
3-(2-Oxopyrrolidin-1-yl)propanoic acid |
77191-38-9 | 95% | 10g |
$500.24 | 2023-09-01 | |
| Alichem | A109007725-25g |
3-(2-Oxopyrrolidin-1-yl)propanoic acid |
77191-38-9 | 95% | 25g |
$947.10 | 2023-09-01 | |
| XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd. | CBR01629-1G |
3-(2-Oxopyrrolidin-1-yl)propanoic acid |
77191-38-9 | 1g |
¥4657.11 | 2023-11-13 | ||
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | 012062-500mg |
3-(2-Oxo-pyrrolidin-1-yl)-propionic acid |
77191-38-9 | 500mg |
1998CNY | 2021-05-08 | ||
| Chemenu | CM112626-5g |
3-(2-oxopyrrolidin-1-yl)propanoic acid |
77191-38-9 | 95% | 5g |
$366 | 2021-08-06 | |
| Chemenu | CM112626-10g |
3-(2-oxopyrrolidin-1-yl)propanoic acid |
77191-38-9 | 95% | 10g |
$585 | 2021-08-06 | |
| Chemenu | CM112626-25g |
3-(2-oxopyrrolidin-1-yl)propanoic acid |
77191-38-9 | 95% | 25g |
$1096 | 2021-08-06 |
3-(2-Oxopyrrolidin-1-yl)propanoic acid Suppliers
3-(2-Oxopyrrolidin-1-yl)propanoic acid Related Literature
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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
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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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
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
Additional information on 3-(2-Oxopyrrolidin-1-yl)propanoic acid
Professional Introduction to 3-(2-Oxopyrrolidin-1-yl)propanoic Acid (CAS No. 77191-38-9)
3-(2-Oxopyrrolidin-1-yl)propanoic acid, a compound with the chemical identifier CAS No. 77191-38-9, has garnered significant attention in the field of pharmaceutical chemistry and bioorganic synthesis. This compound, characterized by its unique structural framework, exhibits promising properties that make it a valuable candidate for various applications, particularly in the development of novel therapeutic agents and biochemical research.
The molecular structure of 3-(2-Oxopyrrolidin-1-yl)propanoic acid consists of a propanoic acid moiety linked to a 2-oxopyrrolidine ring. This configuration imparts distinct chemical and pharmacological attributes, making it a versatile intermediate in synthetic chemistry. The presence of the oxopyrrolidine ring introduces a heterocyclic scaffold that is known to enhance binding affinity and metabolic stability, which are crucial factors in drug design.
In recent years, there has been a surge in research focused on heterocyclic compounds due to their broad spectrum of biological activities. Studies have demonstrated that derivatives of oxopyrrolidine exhibit potential in modulating various biological pathways, including enzyme inhibition and receptor binding. The compound 3-(2-Oxopyrrolidin-1-yl)propanoic acid has been explored as a building block for synthesizing more complex molecules with enhanced pharmacological properties.
One of the most compelling aspects of this compound is its utility in the synthesis of protease inhibitors. Proteases play a critical role in numerous physiological processes, and their dysregulation is associated with several diseases, including cancer and inflammatory disorders. The pyrrolidine moiety in 3-(2-Oxopyrrolidin-1-yl)propanoic acid provides a scaffold that can be modified to target specific protease enzymes, offering a strategic approach for developing targeted therapies.
Recent advancements in computational chemistry have further highlighted the significance of this compound. Molecular modeling studies have revealed that the oxopyrrolidine ring can interact with biological targets in a manner that optimizes binding affinity and selectivity. These insights have guided the design of novel analogs with improved pharmacokinetic profiles, making 3-(2-Oxopyrrolidin-1-yl)propanoic acid an indispensable tool in drug discovery pipelines.
The synthesis of 3-(2-Oxopyrrolidin-1-yl)propanoic acid has also been refined through innovative synthetic methodologies. Researchers have developed efficient multi-step protocols that leverage transition metal catalysis and asymmetric hydrogenation to produce this compound with high enantiomeric purity. These advancements have not only streamlined the production process but also opened new avenues for exploring its applications in chiral chemistry.
In addition to its pharmaceutical applications, 3-(2-Oxopyrrolidin-1-yl)propanoic acid has shown promise in material science. Its unique structural features make it suitable for developing functional materials, such as liquid crystals and polymers, which exhibit enhanced thermal stability and mechanical strength. These properties are particularly relevant in the design of advanced coatings and electronic materials.
The growing interest in green chemistry has also influenced the research on this compound. Efforts have been made to develop environmentally friendly synthetic routes that minimize waste and reduce energy consumption. Such initiatives align with global efforts to promote sustainable practices in chemical manufacturing, ensuring that the production of 3-(2-Oxopyrrolidin-1-yl)propanoic acid is both efficient and eco-conscious.
In conclusion, 3-(2-Oxopyrrolidin-1-yl)propanoic acid (CAS No. 77191-38-9) represents a fascinating compound with diverse applications across multiple scientific disciplines. Its unique structural features and versatile reactivity make it a valuable asset in pharmaceutical research, material science, and green chemistry. As ongoing studies continue to uncover new possibilities, this compound is poised to play an increasingly important role in advancing scientific knowledge and technological innovation.
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