Butan-2-ylsulfanyl-methyl-sulfanylidene-(2,2,2-trifluoroethoxy)phosphorane
Basic information
- CAS
91168-91-1- Standard SMILES
CCC(C)SP(C)(=S)OCC(F)(F)F- InChIKey
SZJHTIXDYPWDTJ-UHFFFAOYSA-N- Molecular formula
- C7H14F3OPS2
- Average molar mass
- 266.3 g/mol
- Monoisotopic mass
- 266.0175789
Names & identifiers
- Preferred name
- Butan-2-ylsulfanyl-methyl-sulfanylidene-(2,2,2-trifluoroethoxy)phosphorane
- IUPAC
- butan-2-ylsulfanyl-methyl-sulfanylidene-(2,2,2-trifluoroethoxy)-λ5-phosphane
Names & synonyms
91168-91-1Butan-2-ylsulfanyl-methyl-sulfanylidene-(2,2,2-trifluoroethoxy)phosphoraneDTXSID10919917S-(Butan-2-yl) O-(2,2,2-trifluoroethyl) methylphosphonodithioateS-Butan-2-yl O-(2,2,2-trifluoroethyl) methylphosphonodithioate
Database identifiers
- CAS
91168-91-1- PubChem CID
- 185087
- DTXSID
DTXSID10919917
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 219
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Compound notes
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