5-iodo-6-methyl-1H-indole
CAS No.:
1000343-19-0
M. Wt:
257.071
M. Fa:
C9H8IN
InChI Key:
YOAULZGUGXGAKS-UHFFFAOYSA-N
Names and Identifiers of 5-iodo-6-methyl-1H-indole
CAS Number |
1000343-19-0 |
|---|---|
IUPAC Name |
5-iodo-6-methyl-1H-indole |
InChI |
InChI=1S/C9H8IN/c1-6-4-9-7(2-3-11-9)5-8(6)10/h2-5,11H,1H3 |
InChIKey |
YOAULZGUGXGAKS-UHFFFAOYSA-N |
Canonical SMILES |
CC1=CC2=C(C=CN2)C=C1I |
Physical and chemical properties of 5-iodo-6-methyl-1H-indole
Acidity coefficient |
16.50±0.30(Predicted) |
|---|---|
Boiling Point |
342.1±22.0 °C at 760 mmHg |
Density |
1.8±0.1 g/cm3 |
Exact Mass |
256.970123 |
Flash Point |
160.7±22.3 °C |
Index of Refraction |
1.735 |
LogP |
3.72 |
Molecular Formula |
C9H8IN |
Molecular Weight |
257.071 |
PSA |
15.79000 |
Storage condition |
2-8°C |
Vapour Pressure |
0.0±0.7 mmHg at 25°C |
Applications of 5-iodo-6-methyl-1H-indole
The unique properties of 5-iodo-6-methyl-1H-indole make it valuable in several fields:
- Pharmaceutical Development: Its potential as an anticancer agent positions it as a candidate for drug development.
- Chemical Research: The compound serves as a building block in organic synthesis and material science due to its reactivity and stability.
Interaction Studies of 5-iodo-6-methyl-1H-indole
Interaction studies involving 5-iodo-6-methyl-1H-indole focus on its binding affinity and biological mechanisms. Research has demonstrated that this compound interacts with various biological targets, influencing pathways related to cell proliferation and apoptosis. In vitro studies have shown promising results against specific cancer cell lines, indicating its potential therapeutic effects.
Biological Activity of 5-iodo-6-methyl-1H-indole
5-Iodo-6-methyl-1H-indole exhibits notable biological activities, particularly in pharmacology. Research indicates that indole derivatives possess:
- Anticancer Properties: Studies have shown that compounds with indole structures can inhibit cancer cell proliferation, suggesting potential applications in cancer therapy.
- Antimicrobial Activity: Indoles are known for their antimicrobial properties, which could extend to 5-iodo-6-methyl-1H-indole.