Cas no 195719-48-3 (1-Benzoyl-pyrrolidine-2-carboxylic Acid)
1-Benzoyl-pyrrolidine-2-carboxylic Acid Chemical and Physical Properties
Names and Identifiers
-
- Proline,1-benzoyl-
- (R)-1-BENZYL PYRROLIDINE-2-CARBOXYLIC ACID
- 1-Benzoylproline
- 1-benzoylpyrrolidine-2-carboxylic acid
- 1-BENZOYL-PYRROLIDINE-2-CARBOXYLIC ACID
- DL-N-benzoylproline
- N-Benzoyl-L-proline
- N-Benzoylproline
- Proline,1-benzoyl
- 1-Benzoyl-DL-proline
- (2S)-1-(benzoyl)proline
- (2S)-1-(oxo-phenylmethyl)-2-pyrrolidinecarboxylic acid
- MFCD09757493
- (S)-1-Benzoylpyrrolidine-2-carboxylic acid
- benzoyl proline
- AS-44644
- SY205527
- EN300-29915
- RQYKQWFHJOBBAO-UHFFFAOYSA-N
- Z85890984
- AKOS000127820
- 1-benzoylpyrrolidine-2-carboxylic acid, AldrichCPR
- SY259866
- NSC164034
- N-(Benzoyl)-L-proline
- SCHEMBL13229
- AB2639
- 1-benzoylpyrrolidine-2-carboxylicacid
- DTXSID70304042
- MFCD03725645
- AB91411
- 5-O-(4,4-DIMETHOXYTRITYL)-2,3-ANHYDROTHYMIDINE
- MFCD08310561
- AKOS016041303
- NSC-164034
- 195719-48-3
- CS-0215766
- 1-Benzoyl-pyrrolidine-2-carboxylic Acid
-
- MDL: MFCD03725645
- Inchi: 1S/C12H13NO3/c14-11(9-5-2-1-3-6-9)13-8-4-7-10(13)12(15)16/h1-3,5-6,10H,4,7-8H2,(H,15,16)
- InChI Key: RQYKQWFHJOBBAO-UHFFFAOYSA-N
- SMILES: OC(C1CCCN1C(C1C=CC=CC=1)=O)=O
Computed Properties
- Exact Mass: 219.09000
- Monoisotopic Mass: 219.09
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 284
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.1
- Topological Polar Surface Area: 57.6?2
Experimental Properties
- Density: 1.296
- Boiling Point: 428.9 °C at 760 mmHg
- Flash Point: 213.2 °C
- PSA: 57.61000
- LogP: 1.31370
1-Benzoyl-pyrrolidine-2-carboxylic Acid Customs Data
- HS CODE:2933990090
- Customs Data:
China Customs Code:
2933990090Overview:
2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. 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:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
1-Benzoyl-pyrrolidine-2-carboxylic Acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | B131173-50mg |
1-Benzoyl-pyrrolidine-2-carboxylic Acid |
195719-48-3 | 50mg |
$ 50.00 | 2022-06-07 | ||
| TRC | B131173-100mg |
1-Benzoyl-pyrrolidine-2-carboxylic Acid |
195719-48-3 | 100mg |
$ 70.00 | 2022-06-07 | ||
| TRC | B131173-500mg |
1-Benzoyl-pyrrolidine-2-carboxylic Acid |
195719-48-3 | 500mg |
$ 295.00 | 2022-06-07 | ||
| abcr | AB236916-500 mg |
1-Benzoylpyrrolidine-2-carboxylic acid |
195719-48-3 | 500 mg |
€272.40 | 2023-07-20 | ||
| abcr | AB236916-1 g |
1-Benzoylpyrrolidine-2-carboxylic acid |
195719-48-3 | 1 g |
€322.50 | 2023-07-20 | ||
| abcr | AB236916-5 g |
1-Benzoylpyrrolidine-2-carboxylic acid |
195719-48-3 | 5 g |
€907.00 | 2023-07-20 | ||
| Chemenu | CM469580-500mg |
1-BENZOYL-PYRROLIDINE-2-CARBOXYLIC ACID |
195719-48-3 | 95%+ | 500mg |
$177 | 2023-01-01 | |
| Chemenu | CM469580-1g |
1-BENZOYL-PYRROLIDINE-2-CARBOXYLIC ACID |
195719-48-3 | 95%+ | 1g |
$265 | 2023-01-01 | |
| Chemenu | CM469580-5g |
1-BENZOYL-PYRROLIDINE-2-CARBOXYLIC ACID |
195719-48-3 | 95%+ | 5g |
$781 | 2023-01-01 | |
| eNovation Chemicals LLC | D621428-1G |
1-benzoylpyrrolidine-2-carboxylic acid |
195719-48-3 | 97% | 1g |
$210 | 2024-07-21 |
1-Benzoyl-pyrrolidine-2-carboxylic Acid Related Literature
-
Benqiang Cui,Jie Yu,Fu-Chao Yu,Ya-Min Li,Kwen-Jen Chang,Yuehai Shen RSC Adv. 2015 5 10386
Additional information on 1-Benzoyl-pyrrolidine-2-carboxylic Acid
Introduction to 1-Benzoyl-pyrrolidine-2-carboxylic Acid (CAS No. 195719-48-3)
1-Benzoyl-pyrrolidine-2-carboxylic Acid, identified by its Chemical Abstracts Service (CAS) number 195719-48-3, is a significant compound in the realm of organic chemistry and pharmaceutical research. This molecule, featuring a benzoyl group attached to a pyrrolidine core, has garnered attention due to its versatile structural framework and potential applications in medicinal chemistry. The pyrrolidine scaffold is particularly noteworthy, as it is a common motif in biologically active molecules, often contributing to interactions with biological targets such as enzymes and receptors.
The synthesis of 1-Benzoyl-pyrrolidine-2-carboxylic Acid involves well-established organic transformations, including condensation reactions and cyclization processes. The benzoyl moiety, introduced through the reaction of pyrrolidine derivatives with benzoyl chloride or benzoyl anhydride, imparts additional functional properties that make this compound a valuable intermediate in the synthesis of more complex molecules. Researchers have leveraged these synthetic pathways to explore derivatives with enhanced pharmacological profiles.
In recent years, the interest in 1-Benzoyl-pyrrolidine-2-carboxylic Acid has been fueled by its potential role in drug discovery. The pyrrolidine ring is a privileged structure in medicinal chemistry, known for its ability to mimic natural amino acid residues and facilitate binding to biological targets. For instance, modifications of this scaffold have been explored in the development of protease inhibitors and kinase inhibitors, which are critical in treating various diseases, including cancer and inflammatory disorders. The benzoyl group further enhances the compound's reactivity, allowing for further derivatization into pharmacophores with tailored properties.
One of the most compelling aspects of 1-Benzoyl-pyrrolidine-2-carboxylic Acid is its utility as a building block for more intricate molecular architectures. Researchers have synthesized numerous analogs by introducing different substituents at various positions on the pyrrolidine ring or the benzoyl group. These derivatives have been evaluated for their biological activity, revealing promising leads for therapeutic intervention. For example, studies have demonstrated that certain derivatives exhibit inhibitory effects on specific enzymes implicated in metabolic pathways relevant to neurological diseases.
The chemical properties of 1-Benzoyl-pyrrolidine-2-carboxylic Acid also make it an attractive candidate for material science applications. The presence of both aromatic and heterocyclic components contributes to its solubility and stability under various conditions, making it suitable for formulations requiring precise control over molecular interactions. Additionally, the compound's ability to undergo selective modifications allows chemists to fine-tune its physical and chemical characteristics for specific applications.
Recent advancements in computational chemistry have further enhanced the understanding of 1-Benzoyl-pyrrolidine-2-carboxylic Acid's reactivity and interactions. Molecular modeling studies have provided insights into how this compound binds to biological targets at the atomic level, guiding the design of more effective derivatives. These computational approaches have been particularly valuable in predicting the pharmacokinetic properties of new analogs, thereby accelerating the drug discovery process.
The pharmaceutical industry has taken note of these developments, with several companies investing in research programs focused on 1-Benzoyl-pyrrolidine-2-carboxylic Acid and its derivatives. Collaborative efforts between academic institutions and industry partners have led to the identification of novel therapeutic candidates that are currently undergoing preclinical evaluation. These efforts highlight the compound's potential as a cornerstone in next-generation drug development.
Beyond pharmaceutical applications, 1-Benzoyl-pyrrolidine-2-carboxylic Acid has shown promise in other areas of chemical research. Its unique structural features make it a useful tool for studying molecular recognition processes, including host-guest chemistry and supramolecular interactions. By incorporating this compound into functional materials or catalysts, researchers aim to develop innovative solutions for challenges in nanotechnology and green chemistry.
The future prospects for 1-Benzoyl-pyrrolidine-2-carboxylic Acid are bright, with ongoing research expected to uncover new applications and refine synthetic methodologies. As our understanding of molecular interactions continues to evolve, this compound will likely play an increasingly important role in both academic research and industrial development. Its versatility and potential make it a cornerstone of modern chemical innovation.
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