Basic information
- CAS
21961-08-0- Standard SMILES
C=CS(=O)(=O)CCCCCC- InChIKey
UBDLKKKJTYCRRJ-UHFFFAOYSA-N- Molecular formula
- C8H16O2S
- Average molar mass
- 176.28 g/mol
- Monoisotopic mass
- 176.08710092
Names & identifiers
- Preferred name
- Sulfone, hexyl vinyl
- IUPAC
- 1-ethenylsulfonylhexane
- English name
- 1-ethenylsulfonylhexane
- Molecular formula
- C8H16O2S
- Molecular weight
- 0
Names & synonyms
Sulfone, hexyl vinyln-Hexyl vinyl sulfone21961-08-0BRN 1857803DTXSID30176368RefChem:382589DTXCID40988591-(ethenesulfonyl)hexaneSCHEMBL10639166Hexylvinyl sulfone1-ethenylsulfonylhexane(hexane-1-sulfonyl)-ethene
Database identifiers
- CAS
21961-08-0- PubChem CID
- 89117
- DTXSID
DTXSID30176368- Nikkaji
- J48.688D
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 187
Physicochemical properties
- Boiling point
- 277.91 °C · 277.91°C (rough estimate)
- Density
- 1.1167 · 1.1167 (rough estimate)
- refractive index
- 1.548 · 1.5480 (estimate)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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