1-Benzofuran-5-carbaldehyde
CAS No.:
10035-16-2
M. Wt:
146.143
M. Fa:
C9H6O2
InChI Key:
LLLBDLDNTMMZHL-UHFFFAOYSA-N
Appearance:
Pale-yellow Solid
Names and Identifiers of 1-Benzofuran-5-carbaldehyde
CAS Number |
10035-16-2 |
|---|---|
EC Number |
674-714-1 |
MDL Number |
MFCD03411182 |
IUPAC Name |
1-benzofuran-5-carbaldehyde |
InChI |
InChI=1S/C9H6O2/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-6H |
InChIKey |
LLLBDLDNTMMZHL-UHFFFAOYSA-N |
Canonical SMILES |
C1=CC2=C(C=CO2)C=C1C=O |
UNSPSC Code |
12352100 |
Physical and chemical properties of 1-Benzofuran-5-carbaldehyde
Boiling Point |
251.5±13.0 °C at 760 mmHg |
|---|---|
Density |
1.2±0.1 g/cm3 |
Exact Mass |
146.036774 |
Flash Point |
110.2±12.5 °C |
Index of Refraction |
1.652 |
LogP |
2.09 |
Melting Point |
50.5ºC |
Molecular Formula |
C9H6O2 |
Molecular Weight |
146.143 |
PSA |
30.21000 |
Storage condition |
under inert gas (nitrogen or Argon) at 2-8°C |
Vapour Pressure |
0.0±0.5 mmHg at 25°C |
Safety Information of 1-Benzofuran-5-carbaldehyde
Applications of 1-Benzofuran-5-carbaldehyde
1-Benzofuran-5-carbaldehyde finds applications in several fields:
- Organic Synthesis: It serves as an important intermediate in the synthesis of various pharmaceuticals and agrochemicals.
- Material Science: Used in the development of polymers and other materials due to its unique structural properties.
- Research Tool: Employed in biological studies to explore its potential therapeutic effects.
Interaction Studies of 1-Benzofuran-5-carbaldehyde
Interaction studies involving 1-benzofuran-5-carbaldehyde focus on its reactivity with biological molecules. These studies help elucidate its mechanism of action and potential pathways for therapeutic effects. For example:
- Binding Affinity Studies: Investigations into how this compound interacts with specific enzymes or receptors can provide insights into its pharmacological potential.
- Metabolic Pathway Analysis: Understanding how this compound is metabolized in biological systems can inform its safety profile and efficacy as a drug candidate.
Biological Activity of 1-Benzofuran-5-carbaldehyde
Research indicates that 1-benzofuran-5-carbaldehyde exhibits various biological activities. It has been studied for its potential as:
- Antimicrobial Agent: Some studies suggest it possesses antimicrobial properties against certain bacteria and fungi.
- Antioxidant Activity: Its structure may confer antioxidant effects, which are beneficial in combating oxidative stress in biological systems.
- Pharmacological Potential: Preliminary studies have indicated potential anti-inflammatory and anticancer activities, warranting further investigation into its therapeutic applications.
Physical sample testing spectrum (NMR) of 1-Benzofuran-5-carbaldehyde
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