Basic information
- CAS
91168-88-6- Standard SMILES
CCC(C)SP(=S)(CC)OCC(F)(F)F- InChIKey
FGARCVKQDQMOOQ-UHFFFAOYSA-N- Molecular formula
- C8H16F3OPS2
- Average molar mass
- 280.3 g/mol
- Monoisotopic mass
- 280.03322896
Names & identifiers
- Preferred name
- Butan-2-ylsulfanyl-ethyl-sulfanylidene-(2,2,2-trifluoroethoxy)phosphorane
- IUPAC
- butan-2-ylsulfanyl-ethyl-sulfanylidene-(2,2,2-trifluoroethoxy)-λ5-phosphane
Names & synonyms
91168-88-6Butan-2-ylsulfanyl-ethyl-sulfanylidene-(2,2,2-trifluoroethoxy)phosphoraneDTXSID40919920S-Butan-2-yl O-(2,2,2-trifluoroethyl) ethylphosphonodithioateS-(Butan-2-yl) O-(2,2,2-trifluoroethyl) ethylphosphonodithioate
Database identifiers
- CAS
91168-88-6- PubChem CID
- 185084
- DTXSID
DTXSID40919920
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 232
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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