structure of 1-methoxy-3-methyl-5-(trifluoromethoxy)benzene

1-methoxy-3-methyl-5-(trifluoromethoxy)benzene

CAS No.: 1000339-56-9
M. Wt: 206.16200
M. Fa: C9H9F3O2
InChI Key: -

Names and Identifiers of 1000339-56-9

CAS Number

1000339-56-9

IUPAC Name

1-methoxy-3-methyl-5-(trifluoromethyloxy)benzene

Canonical SMILES

CC1=CC(=CC(=C1)OC(F)(F)F)OC

Physical and chemical properties of 1000339-56-9

Exact Mass

206.05500

LogP

2.90220

Molecular Formula

C9H9F3O2

Molecular Weight

206.16200

PSA

18.46000

Applications of 1000339-56-9

1-Methoxy-3-methyl-5-(trifluoromethoxy)benzene finds applications in various fields:

  • Pharmaceuticals: Its unique electronic properties make it a candidate for drug development, particularly in creating compounds with improved pharmacokinetic profiles.
  • Agricultural Chemicals: Similar compounds are often investigated for use as herbicides or pesticides due to their biological activity.
  • Material Science: The compound may be utilized in the synthesis of advanced materials where fluorinated functionalities enhance thermal and chemical stability.

Interaction Studies of 1000339-56-9

Interaction studies involving 1-Methoxy-3-methyl-5-(trifluoromethoxy)benzene would typically focus on its binding affinities with biological macromolecules such as proteins or nucleic acids. The trifluoromethoxy group could facilitate hydrogen bonding and other non-covalent interactions, potentially influencing enzyme activity or receptor binding.