5-(4-Acetylphenyl)-3-trifluoromethoxyphenol

Substructure search Find similar structures

Basic information

CAS: 1262003-70-2
Standard SMILES: CC(=O)c1ccc(-c2cc(O)cc(OC(F)(F)F)c2)cc1
InChIKey: AJSAXUMREJYVLS-UHFFFAOYSA-N
Molecular formula: C15H11F3O3
Average molar mass: 296.24 g/mol
Monoisotopic mass: 296.06602869

Names & identifiers

Preferred name: 5-(4-Acetylphenyl)-3-trifluoromethoxyphenol
IUPAC: 1-[4-[3-hydroxy-5-(trifluoromethoxy)phenyl]phenyl]ethanone

Names & synonyms

1262003-70-25-(4-ACETYLPHENYL)-3-TRIFLUOROMETHOXYPHENOL1-[4-[3-hydroxy-5-(trifluoromethoxy)phenyl]phenyl]ethanoneMFCD183162825-(4-Acetylphenyl)-3-trifluoromethoxyphenol, 95%DTXSID306865931-[3'-Hydroxy-5'-(trifluoromethoxy)[1,1'-biphenyl]-4-yl]ethan-1-one

Database identifiers

CAS: 1262003-70-2
PubChem CID: 53222005
DTXSID: DTXSID30686593

Properties

Computed structural properties

XLogP: 4.1
Topological polar surface area: 46.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 3
Heavy atoms: 21
Formal charge: 0
Complexity: 362

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…