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Basic information
- Standard SMILES
CS(=O)(=O)OCC1C2CCC(CC2)C1COS(C)(=O)=O- InChIKey
OGJFGFYUOBEMRG-UHFFFAOYSA-N- Molecular formula
- C12H22O6S2
- Average molar mass
- 326.4 g/mol
- Monoisotopic mass
- 326.08578076
Names & identifiers
- Preferred name
- [3-(Methylsulfonyloxymethyl)-2-bicyclo[2.2.2]octanyl]methyl methanesulfonate
- IUPAC
- [3-(methylsulfonyloxymethyl)-2-bicyclo[2.2.2]octanyl]methyl methanesulfonate
Names & synonyms
NSC149923NSC-149923
Database identifiers
- PubChem CID
- 288646
Properties
Computed structural propertiesFilling in
- XLogP
- 1.8
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 469
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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