Cas no 102989-71-9 (1-(1,3-thiazol-5-yl)prop-2-en-1-one)
1-(1,3-thiazol-5-yl)prop-2-en-1-one Chemical and Physical Properties
Names and Identifiers
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- 2-Propen-1-one,1-(5-thiazolyl)-
- 2-Propen-1-one, 1-(5-thiazolyl)-
- 1-(1,3-thiazol-5-yl)prop-2-en-1-one
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- Inchi: 1S/C6H5NOS/c1-2-5(8)6-3-7-4-9-6/h2-4H,1H2
- InChI Key: JBIXYHFSIXLGLG-UHFFFAOYSA-N
- SMILES: C(C1SC=NC=1)(=O)C=C
Computed Properties
- Exact Mass: 139.00925
- Monoisotopic Mass: 139.009
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 2
- Complexity: 135
- 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
- Topological Polar Surface Area: 58.2A^2
Experimental Properties
- PSA: 29.96
1-(1,3-thiazol-5-yl)prop-2-en-1-one Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
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| Enamine | EN300-1855378-0.05g |
1-(1,3-thiazol-5-yl)prop-2-en-1-one |
102989-71-9 | 0.05g |
$827.0 | 2023-09-18 | ||
| Enamine | EN300-1855378-0.1g |
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| Enamine | EN300-1855378-0.25g |
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102989-71-9 | 0.25g |
$906.0 | 2023-09-18 | ||
| Enamine | EN300-1855378-0.5g |
1-(1,3-thiazol-5-yl)prop-2-en-1-one |
102989-71-9 | 0.5g |
$946.0 | 2023-09-18 | ||
| Enamine | EN300-1855378-1.0g |
1-(1,3-thiazol-5-yl)prop-2-en-1-one |
102989-71-9 | 1g |
$1414.0 | 2023-06-02 | ||
| Enamine | EN300-1855378-2.5g |
1-(1,3-thiazol-5-yl)prop-2-en-1-one |
102989-71-9 | 2.5g |
$1931.0 | 2023-09-18 | ||
| Enamine | EN300-1855378-5.0g |
1-(1,3-thiazol-5-yl)prop-2-en-1-one |
102989-71-9 | 5g |
$4102.0 | 2023-06-02 | ||
| Enamine | EN300-1855378-10.0g |
1-(1,3-thiazol-5-yl)prop-2-en-1-one |
102989-71-9 | 10g |
$6082.0 | 2023-06-02 | ||
| Enamine | EN300-1855378-1g |
1-(1,3-thiazol-5-yl)prop-2-en-1-one |
102989-71-9 | 1g |
$986.0 | 2023-09-18 | ||
| Enamine | EN300-1855378-5g |
1-(1,3-thiazol-5-yl)prop-2-en-1-one |
102989-71-9 | 5g |
$2858.0 | 2023-09-18 |
1-(1,3-thiazol-5-yl)prop-2-en-1-one Related Literature
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
Additional information on 1-(1,3-thiazol-5-yl)prop-2-en-1-one
Comprehensive Overview of 1-(1,3-thiazol-5-yl)prop-2-en-1-one (CAS No. 102989-71-9): Properties, Applications, and Industry Insights
1-(1,3-thiazol-5-yl)prop-2-en-1-one (CAS No. 102989-71-9) is a specialized organic compound featuring a thiazole ring conjugated with a propenone moiety. This unique structure endows it with versatile chemical reactivity, making it valuable in pharmaceutical research, agrochemical development, and material science. The compound's molecular formula (C6H5NOS) and structural features have garnered attention for applications in heterocyclic synthesis and bioactive molecule design.
Recent trends highlight growing interest in thiazole derivatives due to their antimicrobial and anti-inflammatory properties, aligning with global demands for novel therapeutic agents. Researchers frequently search for "thiazole-based drug candidates" or "CAS 102989-71-9 solubility," reflecting its relevance in medicinal chemistry. The compound's Michael acceptor capability (via the α,β-unsaturated ketone) also positions it as a key intermediate in click chemistry and polymer crosslinking applications.
From an industrial perspective, 1-(1,3-thiazol-5-yl)prop-2-en-1-one is synthesized through Knoevenagel condensation or Pd-catalyzed coupling, with purity (>98%) being critical for reproducibility. Analytical techniques like HPLC and NMR are essential for quality control. Environmental considerations drive inquiries about "green synthesis of thiazole compounds," prompting innovations in solvent-free reactions and catalytic methods.
The compound's electronic properties make it intriguing for organic electronics, particularly in OLED materials and photovoltaic cells. Patent analyses reveal its use in light-emitting layers, correlating with the surge in "thiazole optoelectronic applications" searches. Stability studies under varying pH and temperature conditions are frequently cited in technical literature.
In conclusion, CAS 102989-71-9 exemplifies the intersection of structural versatility and functional adaptability. Its role in addressing contemporary challenges—from drug discovery bottlenecks to sustainable material development—ensures continued scientific and commercial relevance. Future research may explore its structure-activity relationships further or optimize large-scale production methodologies.
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