2-(2-Benzyloxyethyl)thio-2',4'-difluoroacetophenone
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
O=C(CSCCOCc1ccccc1)c1ccc(F)cc1F- InChIKey
UOPADADTSUDMJC-UHFFFAOYSA-N- Molecular formula
- C17H16F2O2S
- Average molar mass
- 322.4 g/mol
Names & identifiers
- Preferred name
- 2-(2-Benzyloxyethyl)thio-2',4'-difluoroacetophenone
- IUPAC
- 1-(2,4-difluorophenyl)-2-(2-phenylmethoxyethylsulfanyl)ethanone
Names & synonyms
SCHEMBL7803902UOPADADTSUDMJC-UHFFFAOYSA-N2-(2-benzyloxyethyl)thio-2',4'-difluoroacetophenone
Database identifiers
- PubChem CID
- 18786643
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 51.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 335
Related reactions
3 records
Compound notes
Loading…