2-Bromo-4-(difluoromethoxy)aniline
Names and Identifiers of 2-Bromo-4-(difluoromethoxy)aniline
CAS Number |
1000574-79-7 |
|---|---|
MDL Number |
MFCD09878206 |
IUPAC Name |
2-bromo-4-(difluoromethoxy)aniline |
InChI |
InChI=1S/C7H6BrF2NO/c8-5-3-4(12-7(9)10)1-2-6(5)11/h1-3,7H,11H2 |
InChIKey |
QAIJRQYZGRRNFA-UHFFFAOYSA-N |
Canonical SMILES |
C1=CC(=C(C=C1OC(F)F)Br)N |
UNSPSC Code |
12352100 |
Physical and chemical properties of 2-Bromo-4-(difluoromethoxy)aniline
Exact Mass |
236.96000 |
|---|---|
LogP |
3.21390 |
Molecular Formula |
C7H6BrF2NO |
Molecular Weight |
238.02900 |
PSA |
35.25000 |
Storage condition |
2-8°C(protect from light) |
Safety Information of 2-Bromo-4-(difluoromethoxy)aniline
Applications of 2-Bromo-4-(difluoromethoxy)aniline
The primary applications of 2-Bromo-4-(difluoromethoxy)aniline include:
- Organic Synthesis: It serves as a key intermediate in the synthesis of pharmaceuticals and agrochemicals.
- Medicinal Chemistry: The compound is utilized in developing drugs targeting specific biological pathways.
- Research: It is employed in various chemical research applications due to its unique reactivity profile.
Interaction Studies of 2-Bromo-4-(difluoromethoxy)aniline
Studies on the interactions of 2-Bromo-4-(difluoromethoxy)aniline with biological targets reveal its potential as a modulator in biochemical pathways. The presence of electronegative groups like bromine and difluoromethoxy influences its reactivity and binding affinity, which can lead to significant biological effects such as enzyme inhibition or receptor modulation. These interactions are crucial for understanding its role in drug development.
Biological Activity of 2-Bromo-4-(difluoromethoxy)aniline
The biological activity of 2-Bromo-4-(difluoromethoxy)aniline is primarily linked to its interactions with specific biological targets, including enzymes and receptors. The difluoromethoxy group enhances binding affinity due to its electron-withdrawing properties, which stabilize interactions with target sites. This compound has potential applications in drug development, particularly as an inhibitor or modulator of biological pathways related to various diseases.
Physical sample testing spectrum (NMR) of 2-Bromo-4-(difluoromethoxy)aniline
