Cas no 2228-79-7 (2,5,6,7-tetrahydro-1H-azepin-2-one)
2,5,6,7-tetrahydro-1H-azepin-2-one Chemical and Physical Properties
Names and Identifiers
-
- 6,7-Dihydro-1H-azepin-2(5H)-one
- 1,2,3,4-tetrahydroazepin-7-one
- 1,5,6,7-tetrahydro-2H-Azepin-2-one
- 2,5,6,7-tetrahydro-1H-azepin-2-one
- 1,5,6,7-tetrahydro-2 h -azepin-2-one
- 2H-Azepin-2-one, 1,5,6,7-tetrahydro-
- 2228-79-7
- AKOS006350867
- 3,4-Dihydro-2H-azepin-7-ol #
- MFCD19216497
- DTXSID60339641
- EN300-74672
- azacyclohept-3-ene-2-one
- SCHEMBL651905
-
- MDL: MFCD19216497
- Inchi: 1S/C6H9NO/c8-6-4-2-1-3-5-7-6/h2,4H,1,3,5H2,(H,7,8)
- InChI Key: DGDYEWHHLLKNRD-UHFFFAOYSA-N
- SMILES: O=C1C=CCCCN1
Computed Properties
- Exact Mass: 111.06847
- Monoisotopic Mass: 111.068413911g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 0
- Complexity: 118
- 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: 0.5
- Topological Polar Surface Area: 29.1?2
Experimental Properties
- PSA: 29.1
2,5,6,7-tetrahydro-1H-azepin-2-one Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A449042181-1g |
6,7-Dihydro-1H-azepin-2(5H)-one |
2228-79-7 | 95% | 1g |
$706.86 | 2023-09-02 | |
| Chemenu | CM192049-1g |
1,5,6,7-tetrahydro-2H-azepin-2-one |
2228-79-7 | 95% | 1g |
$830 | 2021-06-10 | |
| Chemenu | CM192049-1g |
1,5,6,7-tetrahydro-2H-azepin-2-one |
2228-79-7 | 95% | 1g |
$929 | 2024-07-18 | |
| eNovation Chemicals LLC | D287140-1g |
6,7-Dihydro-1H-azepin-2(5H)-one |
2228-79-7 | 95% | 1g |
$985 | 2024-06-09 | |
| TRC | T222800-10mg |
2,5,6,7-tetrahydro-1H-azepin-2-one |
2228-79-7 | 10mg |
$ 92.00 | 2023-09-06 | ||
| TRC | T222800-50mg |
2,5,6,7-tetrahydro-1H-azepin-2-one |
2228-79-7 | 50mg |
$ 328.00 | 2023-09-06 | ||
| TRC | T222800-100mg |
2,5,6,7-tetrahydro-1H-azepin-2-one |
2228-79-7 | 100mg |
$ 479.00 | 2023-09-06 | ||
| Enamine | EN300-74672-0.05g |
2,5,6,7-tetrahydro-1H-azepin-2-one |
2228-79-7 | 95% | 0.05g |
$218.0 | 2024-05-23 | |
| Enamine | EN300-74672-0.1g |
2,5,6,7-tetrahydro-1H-azepin-2-one |
2228-79-7 | 95% | 0.1g |
$324.0 | 2024-05-23 | |
| Enamine | EN300-74672-0.25g |
2,5,6,7-tetrahydro-1H-azepin-2-one |
2228-79-7 | 95% | 0.25g |
$463.0 | 2024-05-23 |
2,5,6,7-tetrahydro-1H-azepin-2-one Related Literature
-
Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
-
Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
Additional information on 2,5,6,7-tetrahydro-1H-azepin-2-one
Compound CAS No. 2228-79-7: 2,5,6,7-Tetrahydro-1H-Azepin-2-One
The compound with CAS number 2228-79-7, commonly referred to as 2,5,6,7-tetrahydro-1H-azepin-2-one, is a significant molecule in the field of organic chemistry. This compound belongs to the class of azepinones, which are seven-membered ring structures containing a ketone group. The structure of azepinone derivatives has been extensively studied due to their potential applications in drug discovery and material science.
Recent advancements in synthetic methodologies have enabled the efficient synthesis of azepinone derivatives. For instance, researchers have employed catalytic asymmetric synthesis to construct the seven-membered ring framework with high enantioselectivity. These methods not only enhance the yield but also provide access to enantiopure compounds, which are crucial for pharmacological studies.
The unique structural features of azepinone derivatives make them promising candidates for various applications. In the pharmaceutical industry, these compounds have been explored as potential inhibitors of key enzymes involved in metabolic disorders. For example, studies have shown that certain azepinone derivatives can modulate the activity of histone deacetylases (HDACs), which are implicated in cancer and neurodegenerative diseases.
In addition to their biological applications, azepinone derivatives have also found utility in materials science. Their rigid cyclic structure and conjugated system make them suitable for use in organic electronics. Recent research has focused on incorporating these compounds into light-emitting diodes (LEDs) and photovoltaic devices to improve efficiency and stability.
The synthesis of azepinone derivatives has been optimized through green chemistry approaches. By utilizing renewable feedstocks and minimizing waste generation, these methods align with current sustainability goals. For instance, researchers have developed a one-pot synthesis route using bio-based starting materials to produce azepinones with high purity.
In conclusion, the compound CAS No. 2228-79-7 (azepinone) represents a versatile scaffold with diverse applications across multiple disciplines. Ongoing research continues to uncover new potential uses and improve synthetic strategies for this valuable molecule.
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