Basic information
- CAS
73927-10-3- Standard SMILES
CCCCS(CCCC)=NS(=O)(=O)c1ccccc1- InChIKey
YTJSZLXUGBQHCV-UHFFFAOYSA-N- Molecular formula
- C14H23NO2S2
- Average molar mass
- 301.5 g/mol
- Monoisotopic mass
- 301.11702132
Names & identifiers
- Preferred name
- Sulfilimine, S,S-dibutyl-N-(phenylsulfonyl)-
- IUPAC
- N-(dibutyl-λ4-sulfanylidene)benzenesulfonamide
- English name
- S,S-Dibutyl-N-(phenylsulfonyl)sulfimine
- Molecular formula
- C14H23NO2S2
- Molecular weight
- 301.47
Names & synonyms
Sulfilimine, S,S-dibutyl-N-(phenylsulfonyl)-BRN 3323041S,S-Di-n-butyl-N-(phenylsulfonyl)-sulfilimine73927-10-3DTXSID502245373-11-00-00079 (Beilstein Handbook Reference)RefChem:382572DTXCID80147028N-(Dibutyl-lambda~4~-sulfanylidene)benzenesulfonamideS,S-Dibutyl-N-(phenylsulfonyl)sulfimineBenzenesulfonamide, N-(dibutyl-λ4-sulfanylidene)-
Database identifiers
- CAS
73927-10-3- PubChem CID
- 3056972
- DTXSID
DTXSID50224537- Nikkaji
- J90.671I
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 74.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 355
Physicochemical properties
- Boiling point
- 447.125 · 447.125±28.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.139 · 1.139±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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