Basic information
- Standard SMILES
CCOC(=O)CCc1cc(F)c(OCc2ccccc2OCc2ccccc2)c(F)c1- InChIKey
HSSSCLQGSZREDZ-UHFFFAOYSA-N- Molecular formula
- C25H24F2O4
- Average molar mass
- 426.5 g/mol
Names & identifiers
- Preferred name
- Ethyl 3-(4-{[2-(benzyloxy)benzyl]oxy}-3,5-difluorophenyl)propanoate
- IUPAC
- ethyl 3-[3,5-difluoro-4-[(2-phenylmethoxyphenyl)methoxy]phenyl]propanoate
Names & synonyms
SCHEMBL2349977HSSSCLQGSZREDZ-UHFFFAOYSA-NEthyl 3-(4-{[2-(benzyloxy)benzyl]oxy}-3,5-difluorophenyl)propanoate
Database identifiers
- PubChem CID
- 23136287
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 514
Related reactions
2 records
Compound notes
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