Basic information
- CAS
58594-74-4- Standard SMILES
CC(Oc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1)C(=O)O- InChIKey
VAZKTDRSMMSAQB-UHFFFAOYSA-N- Molecular formula
- C16H13F3O4
- Average molar mass
- 326.27 g/mol
- Monoisotopic mass
- 326.07659356
Names & identifiers
- Preferred name
- Trifop
- IUPAC
- 2-[4-[4-(trifluoromethyl)phenoxy]phenoxy]propanoic acid
Names & synonyms
TrifopTrifop [ISO]58594-74-4Propanoic acid, 2-(4-(4-(trifluoromethyl)phenoxy)phenoxy)-Propanoic acid, 2-[4-[4-(trifluoromethyl)phenoxy]phenoxy]-RefChem:3862892-(4-(4-(Trifluoromethyl)phenoxy)phenoxy)propanoic acid2-[4-[4-(trifluoromethyl)phenoxy]phenoxy]propanoic acid2-{4-[4-(TRIFLUOROMETHYL)PHENOXY]PHENOXY}PROPANOIC ACID59011-30-2SCHEMBL13683143H44EG4VP
Show more names
DTXSID50974146DB-260581NS001338322-[4-(4-trifluoromethylphenoxy)phenoxy]propionic acid2-[p-(p-trifluoromethylphenoxy)phenoxy]-propionic acid2-[4-(4-trifluoromethylphenoxy)phenoxy]-propionic acidalpha-[4-(4-trifluoromethylphenoxy)phenoxy]-propionic acidalpha-[4-(4-Trifluoromethylphenoxy)phenoxy]propionic Acid
Database identifiers
- CAS
58594-74-4- PubChem CID
- 181206
- DTXSID
DTXSID50974146- UNII
- 43H44EG4VP
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 383
Related reactions
35 records
Compound notes
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