Basic information
- Standard SMILES
CCCCCC(C)(O)C=CC1CCC(=O)C1CCCCCCCO- InChIKey
RCHMNNBRYXEVNH-UHFFFAOYSA-N- Molecular formula
- C21H38O3
- Average molar mass
- 338.5 g/mol
Names & identifiers
- Preferred name
- 7-[2-(3-Hydroxy-3-methyloct-1-enyl)-5-oxocyclopentyl]heptanol
- IUPAC
- 2-(7-hydroxyheptyl)-3-(3-hydroxy-3-methyloct-1-enyl)cyclopentan-1-one
Names & synonyms
SCHEMBL11247389RCHMNNBRYXEVNH-UHFFFAOYSA-N7-[2-(3-hydroxy-3-methyloct-1-enyl)-5-oxocyclopentyl]heptanol
Database identifiers
- PubChem CID
- 54259244
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 13
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 377
Related reactions
3 records
Compound notes
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