Cas no 898748-23-7 (2-Bromo-6-(trifluoromethyl)benzodthiazole)
2-Bromo-6-(trifluoromethyl)benzodthiazole Chemical and Physical Properties
Names and Identifiers
-
- 2-bromo-6-(trifluoromethyl)benzo[d]thiazole
- 2-bromo-6-(trifluoromethyl)-1,3-benzothiazole
- 2-Bromo-6-(trifluoromethyl)benzothiazole
- 2-bromo-6-trifluoromethylbenzothiazole
- 2-Bromo-6-(trifluoromethyl)benzothiazole (ACI)
- EN300-7403810
- 898748-23-7
- AKOS015898614
- MFCD08459023
- S12157
- 2-Bromo-6-trifluoromethyl-benzothiazole
- AS-54566
- SCHEMBL3075842
- DTXSID70646595
- DB-000838
- RFNZUTHSKMWKOR-UHFFFAOYSA-N
- 2-Bromo-6-(trifluoromethyl)benzodthiazole
-
- MDL: MFCD08459023
- Inchi: 1S/C8H3BrF3NS/c9-7-13-5-2-1-4(8(10,11)12)3-6(5)14-7/h1-3H
- InChI Key: RFNZUTHSKMWKOR-UHFFFAOYSA-N
- SMILES: FC(C1C=C2C(N=C(S2)Br)=CC=1)(F)F
Computed Properties
- Exact Mass: 280.91200
- Monoisotopic Mass: 280.91217g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 223
- 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: 4.3
- Topological Polar Surface Area: 41.1?2
Experimental Properties
- Density: 1.808
- PSA: 41.13000
- LogP: 4.07760
2-Bromo-6-(trifluoromethyl)benzodthiazole Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | B816623-50mg |
2-Bromo-6-(trifluoromethyl)benzo[d]thiazole |
898748-23-7 | 50mg |
$ 50.00 | 2022-06-06 | ||
| TRC | B816623-100mg |
2-Bromo-6-(trifluoromethyl)benzo[d]thiazole |
898748-23-7 | 100mg |
$ 95.00 | 2022-06-06 | ||
| TRC | B816623-500mg |
2-Bromo-6-(trifluoromethyl)benzo[d]thiazole |
898748-23-7 | 500mg |
$ 320.00 | 2022-06-06 | ||
| Alichem | A059002841-1g |
2-Bromo-6-(trifluoromethyl)benzo[d]thiazole |
898748-23-7 | 95% | 1g |
$273.36 | 2023-08-31 | |
| Chemenu | CM155358-5g |
2-Bromo-6-(trifluoromethyl)benzo[d]thiazole |
898748-23-7 | 95% | 5g |
$800 | 2021-06-08 | |
| Chemenu | CM155358-250mg |
2-Bromo-6-(trifluoromethyl)benzo[d]thiazole |
898748-23-7 | 95%+ | 250mg |
$*** | 2023-05-29 | |
| Chemenu | CM155358-1g |
2-Bromo-6-(trifluoromethyl)benzo[d]thiazole |
898748-23-7 | 95%+ | 1g |
$*** | 2023-05-29 | |
| abcr | AB496490-250 mg |
2-Bromo-6-(trifluoromethyl)benzo[d]thiazole; . |
898748-23-7 | 250MG |
€249.40 | 2023-04-19 | ||
| abcr | AB496490-1 g |
2-Bromo-6-(trifluoromethyl)benzo[d]thiazole; . |
898748-23-7 | 1g |
€546.70 | 2023-04-19 | ||
| eNovation Chemicals LLC | Y0996765-5g |
2-bromo-6-(trifluoromethyl)benzothiazole |
898748-23-7 | 95% | 5g |
$700 | 2024-08-02 |
2-Bromo-6-(trifluoromethyl)benzodthiazole Related Literature
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
-
Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
Additional information on 2-Bromo-6-(trifluoromethyl)benzodthiazole
2-Bromo-6-(Trifluoromethyl)Benzodthiazole: A Comprehensive Overview
The compound with CAS No. 898748-23-7, commonly referred to as 2-Bromo-6-(Trifluoromethyl)Benzodthiazole, has garnered significant attention in the field of organic chemistry and materials science. This molecule is a derivative of benzodthiazole, a heterocyclic compound with a fused benzene and thiazole ring system. The presence of a bromine atom at the 2-position and a trifluoromethyl group at the 6-position introduces unique electronic and steric properties, making it a valuable compound for various applications.
Benzodthiazole derivatives are known for their versatile reactivity and ability to participate in a wide range of chemical transformations. The bromine substituent at the 2-position enhances the molecule's electrophilic character, making it suitable for nucleophilic aromatic substitution reactions. On the other hand, the trifluoromethyl group at the 6-position introduces electron-withdrawing effects, which can modulate the electronic properties of the aromatic ring and influence reactivity in subsequent reactions.
Recent studies have highlighted the potential of 2-Bromo-6-(Trifluoromethyl)Benzodthiazole in drug discovery and materials science. In drug development, this compound has been explored as a building block for constructing bioactive molecules with specific pharmacological profiles. Its ability to undergo various coupling reactions, such as Suzuki-Miyaura and Buchwald-Hartwig couplings, has made it a valuable intermediate in synthesizing complex heterocyclic frameworks.
In materials science, Benzodthiazole derivatives have been investigated for their potential as building blocks in organic electronics. The electron-withdrawing groups, such as the trifluoromethyl substituent, can tune the electronic properties of the material, making it suitable for applications in organic light-emitting diodes (OLEDs) and photovoltaic devices. Recent research has demonstrated that incorporating 2-Bromo-6-(Trifluoromethyl)Benzodthiazole into conjugated polymers can enhance charge transport properties and improve device performance.
The synthesis of 2-Bromo-6-(Trifluoromethyl)Benzodthiazole typically involves multi-step processes that combine aromatic substitution reactions with functional group transformations. One common approach involves the bromination of a precursor benzodthiazole derivative followed by subsequent fluorination to introduce the trifluoromethyl group. These steps require precise control over reaction conditions to ensure high yields and product purity.
From an analytical standpoint, this compound can be characterized using advanced spectroscopic techniques such as nuclear magnetic resonance (NMR), mass spectrometry (MS), and X-ray crystallography. These methods provide insights into its molecular structure, purity, and crystalline properties, which are critical for its application in various fields.
In conclusion, 2-Bromo-6-(Trifluoromethyl)Benzodthiazole is a versatile compound with promising applications in drug discovery and materials science. Its unique electronic properties and reactivity make it an attractive candidate for constructing complex molecular frameworks. As research continues to uncover new potential uses for this compound, its role in advancing organic chemistry and related fields is expected to grow significantly.
898748-23-7 (2-Bromo-6-(trifluoromethyl)benzodthiazole) Related Products
- 898748-19-1(2-bromo-4-(trifluoromethyl)-1,3-benzothiazole)
- 412923-48-9(2-Bromo-4,6-dimethylbenzothiazole, 97%)
- 1188047-34-8(2-bromo-5-(trifluoromethyl)-1,3-benzothiazole)
- 73443-76-2(2-Bromo-4-methylbenzodthiazole)
- 412923-50-3(2-Bromo-6-ethylbenzothiazole)
- 1093106-05-8(2-Bromo-5,6-dimethylbenzo[d]thiazole)
- 131106-70-2(6-(trifluoromethyl)-1,3-benzothiazole)
- 1093107-11-9(2-bromo-5-methyl-1,3-benzothiazole)
- 1190311-64-8(2-Bromo-6-chloro-4-trifluoromethyl-benzothiazole)
- 3622-19-3(2-Bromo-6-methylbenzodthiazole)