4-Diethylphosphinothioylbutyl-diethyl-sulfanylidene-lambda5-phosphane
Basic information
- CAS
1661-15-0- Standard SMILES
CCP(=S)(CC)CCCCP(=S)(CC)CC- InChIKey
PUVAGYLJBXVPIU-UHFFFAOYSA-N- Molecular formula
- C12H28P2S2
- Average molar mass
- 298.4 g/mol
- Monoisotopic mass
- 298.11076724
Names & identifiers
- Preferred name
- 4-Diethylphosphinothioylbutyl-diethyl-sulfanylidene-lambda5-phosphane
- IUPAC
- 4-diethylphosphinothioylbutyl-diethyl-sulfanylidene-λ5-phosphane
- English name
- Phosphine sulfide,[4-(diethylphosphinothioyl)butyl]diethyl-
- Molecular formula
- C12H28P2S2
- Molecular weight
- 298.43
Names & synonyms
NSC2224901661-15-0DTXSID20310113NSC-222490(Butane-1,4-diyl)bis[diethyl(sulfanylidene)-lambda~5~-phosphane]1,4-bis(diethylphosphinothioyl)butanePhosphine sulfide,[4-(diethylphosphinothioyl)butyl]diethyl-
Database identifiers
- CAS
1661-15-0- PubChem CID
- 312434
- DTXSID
DTXSID20310113
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 64.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 230
Physicochemical properties
- Melting point
- 132 · 132.0-132.5 °C
- Boiling point
- 386.6 · 386.6±52.0 °C(Predicted)
- Density
- 1.026 · 1.026±0.06 g/cm3(Predicted)
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Compound notes
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