Basic information
- CAS
56554-88-2- Standard SMILES
CCCCCCCCCCCCC=CCCCC=O- InChIKey
MCCQBYWXEBKFOS-UHFFFAOYSA-N- Molecular formula
- C18H34O
- Average molar mass
- 266.5 g/mol
- Monoisotopic mass
- 266.2609657
Names & identifiers
- Preferred name
- 5-Octadecenal
- IUPAC
- octadec-5-enal
- English name
- 5-Octadecenal
- Molecular formula
- C18H34O
- Molecular weight
- 266.46
Names & synonyms
5-Octadecenal56554-88-2DTXSID50337954RefChem:304507DTXCID10289041MCCQBYWXEBKFOS-BUHFOSPRSA-NOctadec-5-enalDB-263652
Database identifiers
- CAS
56554-88-2- PubChem CID
- 545652
- DTXSID
DTXSID50337954
Properties
Computed structural properties
- XLogP
- 7.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 15
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 196
Physicochemical properties
- Boiling point
- 357.1 · 357.1±21.0 °C(Predicted)
- Density
- 0.841 · 0.841±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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