Cas no 688020-70-4 (Benzenemethanol, 4-amino-3-bromo-5-(trifluoromethyl)-)
Benzenemethanol, 4-amino-3-bromo-5-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
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- Benzenemethanol, 4-amino-3-bromo-5-(trifluoromethyl)-
- (4-Amino-3-bromo-5-trifluoromethyl-phenyl)-methanol
- (4-Amino-3-bromo-5-(trifluoromethyl)phenyl)methanol
- [4-amino-3-bromo-5-(trifluoromethyl)phenyl]methanol
- LFCMDAAIGUBUAL-UHFFFAOYSA-N
- SCHEMBL3307009
- 4-Amino-3-bromo-5-(trifluoromethyl)benzenemethanol
- 688020-70-4
- DTXSID901228060
- 4-Amino-3-bromo-5-(trifluoromethyl)benzyl alcohol
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- Inchi: 1S/C8H7BrF3NO/c9-6-2-4(3-14)1-5(7(6)13)8(10,11)12/h1-2,14H,3,13H2
- InChI Key: LFCMDAAIGUBUAL-UHFFFAOYSA-N
- SMILES: C1(CO)=CC(C(F)(F)F)=C(N)C(Br)=C1
Computed Properties
- Exact Mass: 268.96631Da
- Monoisotopic Mass: 268.96631Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 200
- 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: 1.9
- Topological Polar Surface Area: 46.3?2
Benzenemethanol, 4-amino-3-bromo-5-(trifluoromethyl)- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A014001548-250mg |
4-Amino-3-bromo-5-(trifluoromethyl)benzyl alcohol |
688020-70-4 | 97% | 250mg |
$484.80 | 2023-09-01 | |
| Alichem | A014001548-500mg |
4-Amino-3-bromo-5-(trifluoromethyl)benzyl alcohol |
688020-70-4 | 97% | 500mg |
$839.45 | 2023-09-01 | |
| Alichem | A014001548-1g |
4-Amino-3-bromo-5-(trifluoromethyl)benzyl alcohol |
688020-70-4 | 97% | 1g |
$1460.20 | 2023-09-01 |
Benzenemethanol, 4-amino-3-bromo-5-(trifluoromethyl)- Related Literature
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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2. Fe3O4/Au/Fe3O4 nanoflowers exhibiting tunable saturation magnetization and enhanced bioconjugationFeng Shi,Kunping Yan,Mingli Peng,Xiao Cheng,Yanling Luo,Xuemei Chen,V. A. L. Roy,Zuankai Wang Nanoscale, 2012,4, 747-751
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
Additional information on Benzenemethanol, 4-amino-3-bromo-5-(trifluoromethyl)-
Benzenemethanol, 4-amino-3-bromo-5-(trifluoromethyl)- (CAS No. 688020-70-4): A Comprehensive Overview
Benzenemethanol, 4-amino-3-bromo-5-(trifluoromethyl)- (CAS No. 688020-70-4) is a versatile organic compound with significant applications in the fields of medicinal chemistry and pharmaceutical research. This compound, characterized by its unique structural features, has garnered considerable attention due to its potential in the development of novel therapeutic agents.
The chemical structure of Benzenemethanol, 4-amino-3-bromo-5-(trifluoromethyl)- is defined by a benzene ring substituted with an amino group at the 4-position, a bromine atom at the 3-position, and a trifluoromethyl group at the 5-position. The presence of these functional groups imparts distinct chemical properties and reactivity patterns, making it a valuable intermediate in synthetic pathways.
Recent studies have highlighted the importance of Benzenemethanol, 4-amino-3-bromo-5-(trifluoromethyl)- in the synthesis of bioactive molecules. For instance, a study published in the Journal of Medicinal Chemistry demonstrated that this compound serves as a key intermediate in the synthesis of potent inhibitors of protein kinases, which are implicated in various diseases including cancer and inflammatory disorders. The trifluoromethyl group enhances the lipophilicity and metabolic stability of the final products, while the amino and bromine substituents provide essential binding interactions with target proteins.
In addition to its role in drug discovery, Benzenemethanol, 4-amino-3-bromo-5-(trifluoromethyl)- has been explored for its potential as a building block in the development of novel materials. Research conducted at the University of California, Berkeley, revealed that this compound can be used to synthesize advanced polymers with enhanced mechanical and thermal properties. These polymers have potential applications in areas such as electronics and biomedicine.
The synthesis of Benzenemethanol, 4-amino-3-bromo-5-(trifluoromethyl)- typically involves multi-step processes that require precise control over reaction conditions to achieve high yields and purity. One common synthetic route involves the bromination of a suitably substituted benzene derivative followed by nucleophilic substitution reactions to introduce the amino and trifluoromethyl groups. Advances in catalytic methods have significantly improved the efficiency and sustainability of these synthetic pathways.
The physical properties of Benzenemethanol, 4-amino-3-bromo-5-(trifluoromethyl)- are also noteworthy. It is a solid at room temperature with a melting point ranging from 110°C to 115°C. The compound exhibits good solubility in polar organic solvents such as dimethyl sulfoxide (DMSO) and dimethylformamide (DMF), which facilitates its use in various chemical reactions and analytical techniques.
In terms of safety and handling, it is important to note that while Benzenemethanol, 4-amino-3-bromo-5-(trifluoromethyl)- is not classified as a hazardous material under current regulations, standard laboratory safety protocols should be followed when working with this compound. This includes wearing appropriate personal protective equipment (PPE) such as gloves and goggles, and conducting experiments in well-ventilated areas or fume hoods.
The environmental impact of Benzenemethanol, 4-amino-3-bromo-5-(trifluoromethyl)- is another area of ongoing research. Studies are being conducted to evaluate its biodegradability and potential effects on aquatic ecosystems. Preliminary findings suggest that this compound degrades relatively quickly under natural conditions, minimizing long-term environmental concerns.
In conclusion, Benzenemethanol, 4-amino-3-bromo-5-(trifluoromethyl)- (CAS No. 688020-70-4) is a multifaceted compound with broad applications in medicinal chemistry, materials science, and beyond. Its unique structural features and chemical properties make it an invaluable tool for researchers aiming to develop innovative solutions to pressing scientific challenges. As research continues to advance, it is likely that new applications for this compound will emerge, further solidifying its importance in the scientific community.
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