1-Pentadecen-3-one
Basic information
- CAS
131088-58-9- Standard SMILES
C=CC(=O)CCCCCCCCCCCC- InChIKey
YFURFLWAOAZPGU-UHFFFAOYSA-N- Molecular formula
- C15H28O
- Average molar mass
- 224.38 g/mol
- Monoisotopic mass
- 224.21401551
Names & identifiers
- Preferred name
- 1-Pentadecen-3-one
- IUPAC
- pentadec-1-en-3-one
Names & synonyms
Pentadec-1-en-3-one131088-58-91-Pentadecen-3-oneSCHEMBL3390535DTXSID30400973SY505458
Database identifiers
- CAS
131088-58-9- PubChem CID
- 4220179
- DTXSID
DTXSID30400973- Nikkaji
- J698.857A
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 12
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 172
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…