Basic information
- Standard SMILES
CC1(C)O[C@H](COS(C)(=O)=O)C[C@H](CC(=O)O)O1- InChIKey
UZDBNVGMWJFIJM-SFYZADRCSA-N- Molecular formula
- C10H18O7S
- Average molar mass
- 282.31 g/mol
Names & identifiers
- Preferred name
- [(4R,6S)-6-methanesulfonyloxymethyl-2,2-dimethyl-[1,3]dioxan-4-yl]-acetic acid
- IUPAC
- 2-[(4R,6S)-2,2-dimethyl-6-(methylsulfonyloxymethyl)-1,3-dioxan-4-yl]acetic acid
Names & synonyms
SCHEMBL246313UZDBNVGMWJFIJM-SFYZADRCSA-N[(4R,6S)-6-methanesulfonyloxymethyl-2,2-dimethyl-[1,3]dioxan-4-yl]-acetic acid
Database identifiers
- PubChem CID
- 22850992
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 395
Related reactions
2 records
Compound notes
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