Basic information
- Standard SMILES
CCCC(=O)C1C(=O)CC(C2CCCCC2)CC1=O- InChIKey
UYHRUSXZBIRXKA-UHFFFAOYSA-N- Molecular formula
- C16H24O3
- Average molar mass
- 264.36 g/mol
Names & identifiers
- Preferred name
- 2-Butyryl-5-cyclohexylcyclohexane-1,3-dione
- IUPAC
- 2-butanoyl-5-cyclohexylcyclohexane-1,3-dione
Names & synonyms
SCHEMBL9588424UYHRUSXZBIRXKA-UHFFFAOYSA-N2-butyryl-5-cyclohexylcyclohexane-1,3-dione
Database identifiers
- PubChem CID
- 19796579
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 348
Related reactions
2 records
Compound notes
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