Cas no 70590-43-1 (4,5,6,7-Tetrahydro-1,3-benzothiazol-6-one)
4,5,6,7-Tetrahydro-1,3-benzothiazol-6-one Chemical and Physical Properties
Names and Identifiers
-
- 4,7-dihydro-6(5H)-Benzothiazolone
- 4,5,6,7-Tetrahydro-1,3-benzothiazol-6-one
- 4,5,6,7-tetrahydrobenzothiazol-6-one
- 4,5-DIHYDROBENZO[D]THIAZOL-6(7H)-ONE
- 6(5H)-Benzothiazolone, 4,7-dihydro-
- 70590-43-1
- VCA59043
- 6(5H)-Benzothiazolone, 4,7-dihydro-
- N13364
- SCHEMBL7408577
- 6(5h)-benzo[d]thiazolone,4,7-dihydro-
- 5,7-DIHYDRO-4H-1,3-BENZOTHIAZOL-6-ONE
- FT-0722452
- MFCD18451951
- DA-22007
-
- MDL: MFCD18451951
- Inchi: 1S/C7H7NOS/c9-5-1-2-6-7(3-5)10-4-8-6/h4H,1-3H2
- InChI Key: CTZXVGSIGHCXGQ-UHFFFAOYSA-N
- SMILES: S1C=NC2=C1CC(CC2)=O
Computed Properties
- Exact Mass: 153.025
- Monoisotopic Mass: 153.025
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 160
- 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
- XLogP3: 0.7
4,5,6,7-Tetrahydro-1,3-benzothiazol-6-one Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM153655-1g |
4,5,6,7-Tetrahydro-1,3-benzothiazol-6-one |
70590-43-1 | 95%+ | 1g |
$570 | 2024-07-24 | |
| Chemenu | CM153655-1g |
4,5,6,7-Tetrahydro-1,3-benzothiazol-6-one |
70590-43-1 | 95% | 1g |
$511 | 2021-08-05 | |
| TRC | T111050-250mg |
4,5,6,7-Tetrahydro-1,3-benzothiazol-6-one |
70590-43-1 | 250mg |
$ 950.00 | 2022-06-03 | ||
| TRC | T111050-500mg |
4,5,6,7-Tetrahydro-1,3-benzothiazol-6-one |
70590-43-1 | 500mg |
$ 1580.00 | 2022-06-03 | ||
| Alichem | A059006423-1g |
4,5-Dihydrobenzo[d]thiazol-6(7H)-one |
70590-43-1 | 95% | 1g |
$436.59 | 2023-09-01 | |
| SHANG HAI XIANG HUI YI YAO Technology Co., Ltd. | CB33546-1g |
4,5,6,7-Tetrahydro-1,3-benzothiazol-6-one |
70590-43-1 | 97% | 1g |
3450.00 | 2021-06-01 | |
| eNovation Chemicals LLC | D258490-1g |
4,5-dihydrobenzo[d]thiazol-6(7H)-one |
70590-43-1 | 95% | 1g |
$500 | 2024-05-24 | |
| eNovation Chemicals LLC | D258490-5g |
4,5-dihydrobenzo[d]thiazol-6(7H)-one |
70590-43-1 | 95% | 5g |
$1380 | 2024-05-24 | |
| eNovation Chemicals LLC | D258490-10g |
4,5-dihydrobenzo[d]thiazol-6(7H)-one |
70590-43-1 | 95% | 10g |
$2100 | 2024-05-24 | |
| eNovation Chemicals LLC | D258490-25g |
4,5-dihydrobenzo[d]thiazol-6(7H)-one |
70590-43-1 | 95% | 25g |
$3500 | 2024-05-24 |
4,5,6,7-Tetrahydro-1,3-benzothiazol-6-one Related Literature
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
Additional information on 4,5,6,7-Tetrahydro-1,3-benzothiazol-6-one
Comprehensive Overview of 4,5,6,7-Tetrahydro-1,3-benzothiazol-6-one (CAS No. 70590-43-1): Properties, Applications, and Industry Insights
4,5,6,7-Tetrahydro-1,3-benzothiazol-6-one (CAS No. 70590-43-1) is a heterocyclic organic compound with a unique structural framework combining benzothiazole and ketone functionalities. This compound has garnered significant attention in pharmaceutical and agrochemical research due to its versatile reactivity and potential as a building block for bioactive molecules. The benzothiazole core is known for its prevalence in drug discovery, making derivatives like this one valuable for medicinal chemistry applications.
In recent years, the demand for heterocyclic compounds such as 4,5,6,7-Tetrahydro-1,3-benzothiazol-6-one has surged, driven by advancements in synthetic methodologies and the growing need for novel therapeutic agents. Researchers frequently search for "benzothiazole derivatives uses" or "CAS 70590-43-1 applications," reflecting the compound's relevance in drug development. Its ketone group offers a reactive site for further functionalization, enabling the creation of targeted molecules for conditions like inflammation or microbial infections.
From an industrial perspective, 70590-43-1 is often explored for its role in catalysis and material science. Its stability under various conditions makes it suitable for designing advanced polymers or coatings. Environmental considerations also play a role, with queries like "biodegradability of benzothiazole compounds" gaining traction. While not classified as hazardous, proper handling protocols are recommended to ensure workplace safety during large-scale synthesis.
The synthesis of 4,5,6,7-Tetrahydro-1,3-benzothiazol-6-one typically involves cyclization reactions of precursor amines and carbonyl compounds. Optimizing yield and purity remains a focus area, as highlighted by searches for "efficient synthesis of CAS 70590-43-1." Analytical techniques such as NMR and HPLC are critical for quality control, ensuring compliance with regulatory standards in pharmaceuticals.
Emerging trends link this compound to green chemistry initiatives. Researchers are investigating solvent-free reactions or biocatalytic routes to produce benzothiazole derivatives sustainably. Such innovations align with global efforts to reduce chemical waste, answering queries like "eco-friendly synthesis of heterocycles." Additionally, computational modeling studies predict its interactions with biological targets, streamlining drug design processes.
In summary, 4,5,6,7-Tetrahydro-1,3-benzothiazol-6-one (CAS No. 70590-43-1) represents a multifaceted compound bridging academia and industry. Its applications span from life sciences to advanced materials, fueled by ongoing research into its properties and synthetic adaptability. As interest in specialty chemicals grows, this compound will likely remain a key subject in scientific literature and patent filings.
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