Basic information
- CAS
81267-93-8- Standard SMILES
FC(F)(F)SN1COCN(SC(F)(F)F)C1- InChIKey
KVDVFVOBATVIPO-UHFFFAOYSA-N- Molecular formula
- C5H6F6N2OS2
- Average molar mass
- 288.2 g/mol
- Monoisotopic mass
- 287.98257414
Names & identifiers
- Preferred name
- 3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane
- IUPAC
- 3,5-bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane
Names & synonyms
81267-93-83,5-bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinaneNSC367398DTXSID00320977NSC-3673983,5-Bis[(trifluoromethyl)sulfanyl]-1,3,5-oxadiazinane
Database identifiers
- CAS
81267-93-8- PubChem CID
- 339698
- DTXSID
DTXSID00320977
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 66.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 212
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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