Cas no 1221793-64-1 (1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene)
1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene Chemical and Physical Properties
Names and Identifiers
-
- 1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene
- 1-BROMO-3-ISOBUTOXY-5-TRIFLUOROMETHOXYBENZENE
- BS-21258
- DTXSID50682113
- 1221793-64-1
- 1-bromo-3-(2-methylpropoxy)-5-(trifluoromethoxy)benzene
- CS-0212619
- Benzene, 1-bromo-3-(2-methylpropoxy)-5-(trifluoromethoxy)-
- DB-250350
- MFCD16036131
-
- MDL: MFCD16036131
- Inchi: 1S/C11H12BrF3O2/c1-7(2)6-16-9-3-8(12)4-10(5-9)17-11(13,14)15/h3-5,7H,6H2,1-2H3
- InChI Key: DEFGZGJRSGFCEH-UHFFFAOYSA-N
- SMILES: BrC1C=C(C=C(C=1)OCC(C)C)OC(F)(F)F
Computed Properties
- Exact Mass: 311.997
- Monoisotopic Mass: 311.997
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 233
- 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: 18.5A^2
- XLogP3: 5.1
1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A019087732-5g |
1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene |
1221793-64-1 | 95% | 5g |
$627.00 | 2023-09-03 | |
| abcr | AB273464-1 g |
1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene, 96%; . |
1221793-64-1 | 96% | 1g |
€297.00 | 2023-06-22 | |
| abcr | AB273464-5 g |
1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene, 96%; . |
1221793-64-1 | 96% | 5g |
€1062.00 | 2023-06-22 | |
| abcr | AB273464-1g |
1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene, 96%; . |
1221793-64-1 | 96% | 1g |
€293.60 | 2025-02-17 | |
| abcr | AB273464-5g |
1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene, 96%; . |
1221793-64-1 | 96% | 5g |
€914.30 | 2025-02-17 | |
| abcr | AB273464-250mg |
1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene, 96%; . |
1221793-64-1 | 96% | 250mg |
€173.20 | 2025-02-17 | |
| abcr | AB273464-10g |
1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene, 96%; . |
1221793-64-1 | 96% | 10g |
€1515.40 | 2025-02-17 | |
| Ambeed | A436973-1g |
1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene |
1221793-64-1 | 96% | 1g |
$191.0 | 2024-04-25 | |
| A2B Chem LLC | AA55383-1g |
1-Bromo-3-isobutoxy-5-trifluoromethoxybenzene |
1221793-64-1 | 96% | 1g |
$176.00 | 2024-04-20 | |
| A2B Chem LLC | AA55383-5g |
1-Bromo-3-isobutoxy-5-trifluoromethoxybenzene |
1221793-64-1 | 96% | 5g |
$662.00 | 2024-04-20 |
1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
Additional information on 1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene
Comprehensive Overview of 1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene (CAS No. 1221793-64-1)
1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene (CAS No. 1221793-64-1) is a specialized organic compound that has garnered significant attention in the fields of pharmaceuticals, agrochemicals, and material science. This compound, characterized by its unique bromine and trifluoromethoxy functional groups, is widely utilized as a key intermediate in synthetic chemistry. Its molecular structure, which includes an isobutoxy moiety, enhances its reactivity and solubility, making it a versatile building block for complex molecular architectures.
The growing interest in 1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene is driven by its applications in the development of advanced materials and bioactive molecules. Researchers are particularly focused on its role in cross-coupling reactions, a hot topic in modern organic synthesis. These reactions are pivotal for constructing carbon-carbon bonds, which are fundamental to the creation of pharmaceuticals and functional materials. The compound's trifluoromethoxy group is also a subject of study due to its ability to improve metabolic stability and lipophilicity in drug candidates.
In the context of green chemistry, 1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene is being explored for its potential in sustainable synthesis routes. With the increasing demand for environmentally friendly chemical processes, this compound's compatibility with catalytic methods and solvent-free conditions makes it a promising candidate. Industry professionals and academic researchers alike are investigating its use in flow chemistry and microwave-assisted synthesis, which are trending topics in the chemical community.
Another area of interest is the compound's application in electronic materials. The incorporation of fluorine and bromine atoms into aromatic systems is known to enhance the electronic properties of materials, making them suitable for organic light-emitting diodes (OLEDs) and semiconductors. This aligns with the current focus on next-generation electronics and energy-efficient technologies.
From a commercial perspective, 1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene is available through specialized chemical suppliers who cater to the needs of research and industrial laboratories. Quality control and batch-to-batch consistency are critical factors for buyers, as these ensure reproducibility in experimental and production settings. The compound's storage conditions and handling protocols are also frequently searched topics, reflecting the practical concerns of end-users.
In summary, 1-Bromo-3-isobutoxy-5-(trifluoromethoxy)benzene (CAS No. 1221793-64-1) is a compound of high relevance in contemporary chemical research and industrial applications. Its unique structural features and versatile reactivity make it a valuable tool for scientists working in diverse fields, from medicinal chemistry to materials science. As the demand for innovative and sustainable chemical solutions grows, this compound is poised to play an even more significant role in the future.
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