Basic information
- Standard SMILES
O=S(=O)(CC1CC(S)CO1)c1ccc(F)cc1- InChIKey
XOSAGDUCOMKUMA-UHFFFAOYSA-N- Molecular formula
- C11H13FO3S2
- Average molar mass
- 276.4 g/mol
- Monoisotopic mass
- 276.02901478
Names & identifiers
- Preferred name
- 5-[(4-Fluorophenyl)sulfonylmethyl]oxolane-3-thiol
- IUPAC
- 5-[(4-fluorophenyl)sulfonylmethyl]oxolane-3-thiol
Names & synonyms
SCHEMBL8867440
Database identifiers
- PubChem CID
- 18923969
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 52.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 344
Related reactions
1 records
Compound notes
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