1,3-Cyclohexanediol, dimethanesulfonate, cis-
Basic information
- CAS
39967-13-0- Standard SMILES
CS(=O)(=O)O[C@@H]1CCC[C@H](OS(C)(=O)=O)C1- InChIKey
RZYWEHGAIVDMRD-OCAPTIKFSA-N- Molecular formula
- C8H16O6S2
- Average molar mass
- 272.3 g/mol
- Monoisotopic mass
- 272.03883057
Names & identifiers
- Preferred name
- 1,3-Cyclohexanediol, dimethanesulfonate, cis-
- IUPAC
- [(1S,3R)-3-methylsulfonyloxycyclohexyl] methanesulfonate
Names & synonyms
1,3-Cyclohexanediol, dimethanesulfonate, cis-39967-13-0AI3-61232
Database identifiers
- CAS
39967-13-0- PubChem CID
- 148332
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 372
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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