Cas no 896618-56-7 ((4-chlorophenyl)(thiophen-3-yl)methanone)
(4-chlorophenyl)(thiophen-3-yl)methanone Chemical and Physical Properties
Names and Identifiers
-
- (4-chlorophenyl)-thiophen-3-ylmethanone
- 3-(4-CHLOROBENZOYL)THIOPHENE
- (4-chlorophenyl)(thiophen-3-yl)methanone
- AKOS009491286
- EN300-41857
- CCG-326550
- Z425352990
- 896618-56-7
- DTXSID80578515
- MFCD07699023
- SCHEMBL20448559
-
- MDL: MFCD07699023
- Inchi: 1S/C11H7ClOS/c12-10-3-1-8(2-4-10)11(13)9-5-6-14-7-9/h1-7H
- InChI Key: IFRXOWGOSPXHTG-UHFFFAOYSA-N
- SMILES: ClC1C=CC(=CC=1)C(C1=CSC=C1)=O
Computed Properties
- Exact Mass: 221.99100
- Monoisotopic Mass: 221.9906137g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 211
- 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: 3.5
- Topological Polar Surface Area: 45.3?2
Experimental Properties
- PSA: 45.31000
- LogP: 3.63250
(4-chlorophenyl)(thiophen-3-yl)methanone Customs Data
- HS CODE:2934999090
- Customs Data:
China Customs Code:
2934999090Overview:
2934999090. Other heterocyclic compounds. 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
Summary:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
(4-chlorophenyl)(thiophen-3-yl)methanone Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 202329-1g |
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896618-56-7 | 97% | 1g |
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| Fluorochem | 202329-2g |
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896618-56-7 | 97% | 2g |
£837.00 | 2022-02-28 | |
| Fluorochem | 202329-5g |
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| TRC | C612785-25mg |
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896618-56-7 | 25mg |
$ 50.00 | 2022-06-06 | ||
| TRC | C612785-50mg |
(4-chlorophenyl)(thiophen-3-yl)methanone |
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| TRC | C612785-250mg |
(4-chlorophenyl)(thiophen-3-yl)methanone |
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$ 320.00 | 2022-06-06 | ||
| Matrix Scientific | 103560-1g |
3-(4-Chlorobenzoyl)thiophene |
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$517.00 | 2023-09-05 | ||
| Matrix Scientific | 103560-2g |
3-(4-Chlorobenzoyl)thiophene |
896618-56-7 | 2g |
$739.00 | 2023-09-05 | ||
| Matrix Scientific | 103560-5g |
3-(4-Chlorobenzoyl)thiophene |
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| Chemenu | CM297033-1g |
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(4-chlorophenyl)(thiophen-3-yl)methanone Related Literature
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
Additional information on (4-chlorophenyl)(thiophen-3-yl)methanone
Introduction to (4-Chlorophenyl)(Thiophen-3-yl)Methanone (CAS No. 896618-56-7)
(4-Chlorophenyl)(thiophen-3-yl)methanone, also known by its CAS number 896618-56-7, is a versatile organic compound that has garnered significant attention in the fields of medicinal chemistry and materials science. This compound is characterized by its unique molecular structure, which combines a chlorophenyl group and a thiophene moiety, linked through a carbonyl group. The combination of these functional groups imparts distinct chemical and physical properties, making it a valuable candidate for various applications.
The molecular formula of (4-chlorophenyl)(thiophen-3-yl)methanone is C11H7ClOS, with a molecular weight of approximately 220.7 g/mol. The compound's structure features a planar thiophene ring and a substituted phenyl ring, which are connected via a carbonyl bridge. This arrangement not only influences the compound's electronic properties but also its reactivity and solubility characteristics.
In recent years, (4-chlorophenyl)(thiophen-3-yl)methanone has been extensively studied for its potential applications in the development of novel pharmaceuticals. Research has shown that this compound exhibits promising biological activities, including anti-inflammatory, anti-cancer, and anti-microbial properties. For instance, studies have demonstrated that (4-chlorophenyl)(thiophen-3-yl)methanone can inhibit the activity of specific enzymes involved in inflammatory pathways, making it a potential lead compound for the treatment of inflammatory diseases.
Moreover, the compound's ability to interact with biological targets has been explored in the context of cancer research. Preclinical studies have indicated that (4-chlorophenyl)(thiophen-3-yl)methanone can induce apoptosis in cancer cells by modulating key signaling pathways. This property makes it an attractive candidate for further investigation as an anti-cancer agent.
Beyond its medicinal applications, (4-chlorophenyl)(thiophen-3-yl)methanone has also found use in materials science. The presence of the thiophene moiety confers unique electronic properties to the compound, which can be exploited in the development of organic semiconductors and other advanced materials. Recent advancements in organic electronics have highlighted the potential of thiophene-containing compounds like (4-chlorophenyl)(thiophen-3-yl)methanone in applications such as organic photovoltaics and field-effect transistors.
The synthesis of (4-chlorophenyl)(thiophen-3-yl)methanone can be achieved through various routes, including Friedel-Crafts acylation and other carbonylation reactions. These methods allow for the efficient production of the compound with high purity and yield. The choice of synthetic pathway often depends on factors such as cost, scalability, and environmental impact.
In terms of safety and handling, it is important to note that while (4-chlorophenyl)(thiophen-3-yl)methanone is not classified as a hazardous material, proper precautions should be taken during its handling to ensure safety. This includes using appropriate personal protective equipment (PPE) and following standard laboratory practices to minimize exposure risks.
To summarize, (4-chlorophenyl)(thiophen-3-yl)methanone (CAS No. 896618-56-7) is a multifaceted compound with significant potential in both medicinal chemistry and materials science. Its unique structural features and diverse biological activities make it an intriguing subject for ongoing research and development. As new studies continue to uncover its full range of applications, this compound is likely to play an increasingly important role in advancing various scientific fields.
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