Sulfurous acid, bis(2-methylpropyl) ester
Basic information
- CAS
18748-27-1- Standard SMILES
CC(C)COS(=O)OCC(C)C- InChIKey
SYKANJDVMZPZMM-UHFFFAOYSA-N- Molecular formula
- C8H18O3S
- Average molar mass
- 194.29 g/mol
- Monoisotopic mass
- 194.09766561
Names & identifiers
- Preferred name
- Sulfurous acid, bis(2-methylpropyl) ester
- IUPAC
- bis(2-methylpropyl) sulfite
- English name
- Sulfurous acid, bis(2-methylpropyl) ester
- Molecular formula
- C8H18O3S
- Molecular weight
- 194.29172
Names & synonyms
Sulfurous acid, bis(2-methylpropyl) esterbis(2-methylpropyl) sulfiteDiisobutyl sulfiteSulfurous acid, diisobutyl estersulfurous acid diisobutyl ester18748-27-1SCHEMBL777223DTXSID30337997SYKANJDVMZPZMM-UHFFFAOYSA-Nsulfurous acid bis-(2-methylpropyl) esterDi-iso-butyl sulfite
Database identifiers
- CAS
18748-27-1- PubChem CID
- 545833
- DTXSID
DTXSID30337997- Nikkaji
- J139.579C
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 54.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 120
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Physicochemical properties
- Boiling point
- 240.75 °C · 240.75°C (rough estimate)
- Density
- 0.9862 · 0.9862
- refractive index
- 1.4268 · 1.4268
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…