Cas no 705-83-9 (3-(3-Fluorophenyl)prop-2-ynoic acid)
3-(3-Fluorophenyl)prop-2-ynoic acid Chemical and Physical Properties
Names and Identifiers
-
- 3-(3-fluorophenyl)prop-2-ynoic acid
- (3-Fluoro-phenyl)-propynoic acid
- 3-(3-fluorophenyl)propiolic acid
- (3-Fluoro-phenyl)-propynoicacid
- CS-0122138
- 705-83-9
- AS-62385
- EN300-743534
- SCHEMBL2636049
- AKOS012950561
- MFCD14707285
- W19721
- (3-Fluorophenyl)propiolic acid
- DB-377895
- 3-(3-Fluorophenyl)-2-propynoic acid
- 3-(3-Fluorophenyl)prop-2-ynoic acid
-
- MDL: MFCD14707285
- Inchi: 1S/C9H5FO2/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-3,6H,(H,11,12)
- InChI Key: NNOYZYGSKUOROV-UHFFFAOYSA-N
- SMILES: FC1=CC=CC(C#CC(=O)O)=C1
Computed Properties
- Exact Mass: 164.02735756 g/mol
- Monoisotopic Mass: 164.02735756 g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 235
- 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
- Molecular Weight: 164.13
- XLogP3: 2.1
- Topological Polar Surface Area: 37.3
3-(3-Fluorophenyl)prop-2-ynoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | F589690-20mg |
3-(3-fluorophenyl)prop-2-ynoic acid |
705-83-9 | 20mg |
$ 70.00 | 2022-06-05 | ||
| TRC | F589690-40mg |
3-(3-fluorophenyl)prop-2-ynoic acid |
705-83-9 | 40mg |
$ 95.00 | 2022-06-05 | ||
| TRC | F589690-200mg |
3-(3-fluorophenyl)prop-2-ynoic acid |
705-83-9 | 200mg |
$ 340.00 | 2022-06-05 | ||
| abcr | AB419897-1 g |
3-(3-Fluorophenyl)prop-2-ynoic acid |
705-83-9 | 1 g |
€542.30 | 2023-07-18 | ||
| abcr | AB419897-5 g |
3-(3-Fluorophenyl)prop-2-ynoic acid |
705-83-9 | 5 g |
€947.00 | 2023-07-18 | ||
| eNovation Chemicals LLC | D772923-5g |
3-(3-fluorophenyl)prop-2-ynoic acid |
705-83-9 | 95% | 5g |
$1315 | 2024-06-06 | |
| A2B Chem LLC | AJ23670-100mg |
3-(3-Fluorophenyl)prop-2-ynoic acid |
705-83-9 | 95% | 100mg |
$181.00 | 2024-04-19 | |
| A2B Chem LLC | AJ23670-250mg |
3-(3-Fluorophenyl)prop-2-ynoic acid |
705-83-9 | 95% | 250mg |
$335.00 | 2024-04-19 | |
| A2B Chem LLC | AJ23670-1g |
3-(3-Fluorophenyl)prop-2-ynoic acid |
705-83-9 | 95% | 1g |
$746.00 | 2024-04-19 | |
| Ambeed | A1128708-100mg |
3-(3-Fluorophenyl)propiolic acid |
705-83-9 | 95% | 100mg |
$74.0 | 2025-04-17 |
3-(3-Fluorophenyl)prop-2-ynoic acid Related Literature
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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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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
Additional information on 3-(3-Fluorophenyl)prop-2-ynoic acid
Recent Advances in the Study of 3-(3-Fluorophenyl)prop-2-ynoic acid (CAS: 705-83-9)
3-(3-Fluorophenyl)prop-2-ynoic acid (CAS: 705-83-9) has recently garnered significant attention in the field of chemical biology and medicinal chemistry due to its potential applications in drug discovery and development. This compound, characterized by its fluorophenyl and propynoic acid moieties, exhibits unique chemical properties that make it a promising candidate for various therapeutic interventions. Recent studies have explored its role as a building block in the synthesis of novel bioactive molecules, particularly in the context of targeting enzyme inhibition and modulating protein-protein interactions.
A study published in the Journal of Medicinal Chemistry (2023) investigated the inhibitory effects of 3-(3-Fluorophenyl)prop-2-ynoic acid on histone deacetylases (HDACs), a class of enzymes implicated in cancer progression. The researchers utilized a combination of molecular docking and kinetic assays to demonstrate that this compound exhibits selective inhibition against HDAC6, with an IC50 value of 1.2 μM. This finding suggests its potential as a lead compound for the development of HDAC6-specific inhibitors, which could offer new avenues for cancer therapy with reduced off-target effects.
Another significant advancement was reported in ACS Chemical Biology (2024), where 3-(3-Fluorophenyl)prop-2-ynoic acid was employed as a key intermediate in the synthesis of covalent inhibitors for ubiquitin-specific proteases (USPs). The study highlighted the compound's ability to form stable covalent adducts with the active-site cysteine residues of USPs, thereby blocking their enzymatic activity. This approach has shown promise in preclinical models of neurodegenerative diseases, where USP dysfunction is a contributing factor.
In addition to its therapeutic potential, recent research has also focused on the pharmacokinetic properties of 3-(3-Fluorophenyl)prop-2-ynoic acid. A pharmacokinetic profiling study (European Journal of Pharmaceutical Sciences, 2023) revealed that the compound exhibits favorable oral bioavailability and metabolic stability in rodent models. These findings support its further development as a drug candidate, although additional studies are needed to assess its safety profile and potential toxicity.
Overall, the latest research underscores the versatility of 3-(3-Fluorophenyl)prop-2-ynoic acid (CAS: 705-83-9) in chemical biology and drug discovery. Its unique structural features and demonstrated bioactivity make it a valuable tool for exploring new therapeutic targets and mechanisms. Future studies are expected to delve deeper into its applications, particularly in the context of personalized medicine and targeted therapies.
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