Basic information
- CAS
18229-17-9- Standard SMILES
CCCCCCC(=O)C(O)CCCCCC- InChIKey
PQESRTWBQJRGON-UHFFFAOYSA-N- Molecular formula
- C14H28O2
- Average molar mass
- 228.37 g/mol
- Monoisotopic mass
- 228.20893014
Names & identifiers
- Preferred name
- 8-Hydroxytetradecan-7-one
- IUPAC
- 8-hydroxytetradecan-7-one
- English name
- 8-hydroxytetradecan-7-one
- Molecular formula
- C14H28O2
- Molecular weight
- 228.37
Names & synonyms
8-Hydroxytetradecan-7-one18229-17-9EINECS 242-109-87-hydroxytetradecan-8-oneSCHEMBL7768831DTXSID20939565NS000519118-Hydroxy-7-tetradecanone7-Tetradecanone, 8-hydroxy-
Database identifiers
- CAS
18229-17-9- PubChem CID
- 86681
- DTXSID
DTXSID20939565- EC Number
- 242-109-8
- Nikkaji
- J266.067I
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 166
Physicochemical properties
- Boiling point
- 263.2 · 263.2±8.0 °C(Predicted)
- Density
- 0.896 · 0.896±0.06 g/cm3(Predicted)
- pka
- 13.52 · 13.52±0.20(Predicted)
Related reactions
3 records
Compound notes
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