2,4-Dibromo-5-fluoroaniline
CAS No.:
1000578-04-0
M. Wt:
268.909
M. Fa:
C6H4Br2FN
InChI Key:
ISAQGADJGBSNRH-UHFFFAOYSA-N
Appearance:
Brown Solid
Names and Identifiers of 2,4-Dibromo-5-fluoroaniline
CAS Number |
1000578-04-0 |
|---|---|
MDL Number |
MFCD09878124 |
IUPAC Name |
2,4-dibromo-5-fluoroaniline |
InChI |
InChI=1S/C6H4Br2FN/c7-3-1-4(8)6(10)2-5(3)9/h1-2H,10H2 |
InChIKey |
ISAQGADJGBSNRH-UHFFFAOYSA-N |
Canonical SMILES |
C1=C(C(=CC(=C1F)Br)Br)N |
UNSPSC Code |
12352100 |
Physical and chemical properties of 2,4-Dibromo-5-fluoroaniline
Acidity coefficient |
0.82±0.10(Predicted) |
|---|---|
Boiling Point |
262.0±35.0 °C at 760 mmHg |
Density |
2.1±0.1 g/cm3 |
Exact Mass |
266.869446 |
Flash Point |
112.3±25.9 °C |
Index of Refraction |
1.634 |
LogP |
3.56 |
Molecular Formula |
C6H4Br2FN |
Molecular Weight |
268.909 |
Storage condition |
Keep in dark place,Inert atmosphere,Room temperature |
Vapour Pressure |
0.0±0.5 mmHg at 25°C |
Safety Information of 2,4-Dibromo-5-fluoroaniline
Applications of 2,4-Dibromo-5-fluoroaniline
2,4-Dibromo-5-fluoroaniline finds applications in several areas:
- Pharmaceutical Intermediates: It serves as an important intermediate in the synthesis of various pharmaceuticals, particularly fluoroquinolone antibiotics.
- Material Science: Its unique properties make it suitable for developing specialty polymers and dyes.
Interaction Studies of 2,4-Dibromo-5-fluoroaniline
Studies on the interactions of 2,4-Dibromo-5-fluoroaniline reveal its potential effects on biological systems:
- Metabolic Pathways: Research indicates that it can alter pathways involving cytochrome P450 enzymes, impacting drug metabolism and efficacy.
- Gene Regulation: The compound has been observed to modulate the expression of genes related to stress responses and apoptosis pathways.
Biological Activity of 2,4-Dibromo-5-fluoroaniline
2,4-Dibromo-5-fluoroaniline exhibits significant biological activity:
- Enzyme Interaction: It has been shown to interact with cytochrome P450 enzymes, which are crucial for drug metabolism. This interaction can lead to either inhibition or activation of these enzymes, affecting metabolic pathways.
- Cellular Effects: The compound influences cellular processes such as gene expression and apoptosis. It has been linked to changes in oxidative stress responses and cell survival mechanisms, making it a valuable tool in cancer research.
Physical sample testing spectrum (NMR) of 2,4-Dibromo-5-fluoroaniline
Cas:372-19-0
