Basic information
- Standard SMILES
C[C@@H]1CC[C@@H](C)[C@]2(CO2)C1(C)C- InChIKey
MXULUGIIMHJYHU-FXPVBKGRSA-N- Molecular formula
- C11H20O
- Average molar mass
- 168.28 g/mol
- Monoisotopic mass
- 168.15141526
Names & identifiers
- Preferred name
- (-)-(3R,5R,8R)-4,4,5,8-tetramethyl-1-oxaspiro[2.5]octane
- IUPAC
- (3R,5R,8R)-4,4,5,8-tetramethyl-1-oxaspiro[2.5]octane
Names & synonyms
SCHEMBL8201997MXULUGIIMHJYHU-FXPVBKGRSA-N(-)-(3R,5R,8R)-4,4,5,8-tetramethyl-1-oxaspiro[2.5]octane
Database identifiers
- PubChem CID
- 54096983
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 197
Related reactions
1 records
Compound notes
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