structure of 4-[(3-Fluorophenyl)methoxy]-3-[(3-fluorophenyl)methyl]benzaldehyde

4-[(3-Fluorophenyl)methoxy]-3-[(3-fluorophenyl)methyl]benzaldehyde

CAS No.: 1000370-24-0
M. Wt: 338.34700
M. Fa: C21H16F2O2
InChI Key: VIFRWCOSLMTDSZ-UHFFFAOYSA-N
Appearance: Solid

Names and Identifiers of 1000370-24-0

CAS Number

1000370-24-0

IUPAC Name

4-[(3-fluorophenyl)methoxy]-3-[(3-fluorophenyl)methyl]benzaldehyde

InChI

InChI=1S/C21H16F2O2/c22-19-5-1-3-15(11-19)9-18-10-16(13-24)7-8-21(18)25-14-17-4-2-6-20(23)12-17/h1-8,10-13H,9,14H2

InChIKey

VIFRWCOSLMTDSZ-UHFFFAOYSA-N

Canonical SMILES

C1=CC(=CC(=C1)F)CC2=C(C=CC(=C2)C=O)OCC3=CC(=CC=C3)F

Physical and chemical properties of 1000370-24-0

Boiling Point

464.5±45.0 ℃ at 760 mmHg

Density

1.236±0.06 g/cm3

Exact Mass

338.11200

LogP

4.94710

Molecular Formula

C21H16F2O2

Molecular Weight

338.34700

PSA

26.30000

Storage condition

Inert atmosphere,Room Temperature

Safety Information of 1000370-24-0

Pictograms

Signal Word

 Warning

Safety Data Sheet
Supports customized editing of SDS information and downloading in PDF documents.

Applications of 1000370-24-0

4-[(3-Fluorophenyl)methoxy]-3-[(3-fluorophenyl)methyl]benzaldehyde has several applications:

  • Pharmaceutical Intermediate: It serves as an intermediate in the synthesis of various pharmaceuticals, particularly those targeting cancer and neurological disorders.
  • Research Tool: Used in biological studies to explore mechanisms of action related to its unique structural features.
  • Organic Synthesis: Acts as a building block for more complex organic molecules in synthetic chemistry.

Interaction Studies of 1000370-24-0

Studies involving interaction with biological targets are essential for understanding the pharmacodynamics of this compound. Research has indicated interactions with:

  • Cytochrome P450 Enzymes: These enzymes play a crucial role in drug metabolism, and understanding how this compound interacts with them can inform its therapeutic potential and toxicity profile.
  • Receptor Binding Studies: Investigating its binding affinity to specific receptors can elucidate its mechanism of action in biological systems.

Biological Activity of 1000370-24-0

Research indicates that compounds like 4-[(3-Fluorophenyl)methoxy]-3-[(3-fluorophenyl)methyl]benzaldehyde may exhibit significant biological activities, including:

  • Anticancer Properties: Similar compounds have shown potential in inhibiting cancer cell proliferation.
  • Antimicrobial Activity: The fluorinated aromatic structures may enhance the effectiveness against various pathogens.
  • Neuroprotective Effects: Some derivatives have been studied for their potential in treating neurodegenerative diseases.

Retrosynthesis analysis of 1000370-24-0

  • Route#1

    Cas:123-08-0
    Cas:456-42-8
    Cas:1000370-24-0