2-Cyclohexen-1-one, 5-(1-hydroxy-1-methyldecyl)-2-methyl-, (5R)-
Basic information
- CAS
383877-59-6- Standard SMILES
CCCCCCCCCC(C)(O)[C@@H]1CC=C(C)C(=O)C1- InChIKey
IIFAIQXAEXUOHZ-PYUWXLGESA-N- Molecular formula
- C18H32O2
- Average molar mass
- 280.4 g/mol
- Monoisotopic mass
- 280.24023026
Names & identifiers
- Preferred name
- 2-Cyclohexen-1-one, 5-(1-hydroxy-1-methyldecyl)-2-methyl-, (5R)-
- IUPAC
- (5R)-5-(2-hydroxyundecan-2-yl)-2-methylcyclohex-2-en-1-one
Names & synonyms
383877-59-62-Cyclohexen-1-one, 5-(1-hydroxy-1-methyldecyl)-2-methyl-, (5R)-DTXSID504325795-(2-hydroxyundecan-2-yl)-2-methylcyclohex-2-en-1-one
Database identifiers
- CAS
383877-59-6- PubChem CID
- 9900366
- DTXSID
DTXSID50432579
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 332
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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